Plant Summary
Plant Information
TCMBank_ID: | TCMBANKHE004095 |
ID: | TCMBANKHE004095 |
植物拉丁名: |
|
功能与主治: | To relieve dyspnea and cough by eliminating cold-phlegm, to reduce modulation, and to relieve pain by removing the obstruction of collateral./Vomiting with stomach cold, pain in heart and abdomen, lung cold cough, impediment pain, throat impediment, flowing phlegm, knocks and falls. |
药用植物名: | 芥子 |
药用部位: | seed |
治疗类型: | 化痰药 |
TCM_ID_id: | 2909 |
SymMap_id: | 201 |
TCMSP_id: | 982 |
植物对应的化合物
| 化合物ID | 化合物名 | 别名 | 分子式 | 分子质量 | Smiles |
|---|
| TCMBANKIN000133 | tsugaricacid b | C33H52O5 | 528.8 g/mol | CC(CCC(C1C(CC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)O)C(=O)O)C(=C)C | |
| TCMBANKIN000140 | 3β-oxo-formyl-7β,12β-dihydroxy-5α-lanost-11,15,23-trioxo-8-en(e)-26-0icacid | ||||
| TCMBANKIN000211 | ganodericacid c | ganoderic acid c | C30H42O7 | 514.6 g/mol | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C |
| TCMBANKIN000950 | ganoderic acid Md | C36H54O8 | 614.81 | CC(C1CCC2(C1(CCC3=C2C(CC4C3(CCC(C4(C)C)OC(=O)C)C)OC)C)C)C(CC=C(C)C(=O)O)OC(=O)C | |
| TCMBANKIN001478 | Riddelline | riddelline | C18H23NO6 | 349.38 | CC=C1CC(=C)C(C(=O)OCC2=CCN3C2C(CC3)OC1=O)(CO)O |
| TCMBANKIN001648 | ganode-7,9-dien-ricacid y | C30H46O3 | |||
| TCMBANKIN001672 | Ganoderic acid alpha | ganodericacidα | C32H46O9 | 574.7 | CC(CC(=O)CC(C)C(=O)O)C1CC(C2(C1(C(C(=O)C3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)OC(=O)C)C)C)O |
| TCMBANKIN002645 | lucidenicacid lm1 | C27H40O6 | 460.6 g/mol | CC(CCC(=O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)C)C | |
| TCMBANKIN003087 | 2-phenyl-1H-isoquinoline | N-Phenyl-2-naphthalene amine | 207.29 | ||
| TCMBANKIN003622 | 2-(2-phenylethyl)-6-[[(5S,6R,7R,8S)-5,6,7-trihydroxy-4-keto-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-8-yl]oxy]chromone | 2-(2-phenylethyl)-6-[[(5S,6R,7R,8S)-5,6,7-trihydroxy-4-oxo-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-8-yl]oxy]-4-chromenone; 2-(2-phenylethyl)-6-[[(5S,6R,7R,8S)-5,6,7-trihydroxy-4-oxo-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-8-yl]oxy]chromen-4-one | 566.64 | ||
| TCMBANKIN005303 | 8β,9α-dihydroganodericacid j methyl ester | C31H46O7 | CC(CC(=O)CC(C)C(=O)OC)C1CC(C2(C1(CC(=O)C3C2C(=O)CC4C3(CCC(=O)C4(C)C)C)C)C)O | ||
| TCMBANKIN005768 | ganodepurine | CC(=O)CC(C)(C)N1C=NC2=C1N=CN=C2N | |||
| TCMBANKIN006091 | ganodericacid ε | C30H44O7 | |||
| TCMBANKIN006711 | sinapic acid | A829376; (E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoic acid; 3-(3,5-Dimethoxy-4-hydroxyphenyl)acrylate; ST5308240; (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid; InChI=1/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13; 85429_FLUKA; 2-propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-, (2E)-; 3,5-Dimethoxy-4-hydroxycinnamic acid; (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate; (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid; ZB005508; 2-propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-; C00482; sinapicacid; 49508_FLUKA; MLS001066354; Sinapic acid; SXX; 3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid; 3,5-dimethoxy-4-hydroxycinnamic acid; 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid; trans-sinapate; AIDS024970; (E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoate; AC1NUT1R; NSC59261; (E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid; CHEBI:30023; 4-Hydroxy-3,5-dimethoxy-cinnamic acid; 2-Propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-, (E)-; Synapoic acid; SINAPINATE; (E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)acrylic acid; 530-59-6; AIDS-024970; D7927_SIGMA; SMR000471879; (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoate; (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid; CHEBI:15714; CINNAMIC ACID,3,5-DIMETHOXY,4-HYDROXY; (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate; Cinnamic acid, 4-hydroxy-3,5-dimethoxy-, (E)-; (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid; InChI=1/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3; 7362-37-0; 3-(4-hydroxy-3,5-dimethoxy-phenyl)acrylic acid; 3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoic acid; 3,5-dimethoxy-4-hydroxycinnamate; 4-hydroxy-3,5-dimethoxycinnamate | C11H12O5 | 224.21 | COC1=CC(=CC(=C1O)OC)C=CC(=O)O |
| TCMBANKIN006753 | (1S,4S)-1-isopropyl-4-methyl-3-bicyclo[3.1.0]hexanone | (1S,4S)-1-isopropyl-4-methyl-bicyclo[3.1.0]hexan-3-one; (1S,4S)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one; (1S,4S)-4-methyl-1-propan-2-yl-bicyclo[3.1.0]hexan-3-one | C10H16O | 152.23 | |
| TCMBANKIN007695 | ganode-8-en-ricacid f | C32H42O9 | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(C(C(=O)C3=C2C(=O)CC4C3(CCC(=O)C4(C)C)C)OC(=O)C)C)C | ||
| TCMBANKIN008698 | lucidenicacid a | C27H38O6 | 458.6 g/mol | CC(CCC(=O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C | |
| TCMBANKIN009452 | Pentyl isothiocyanate | BB_SC-1846; EINECS 211-075-6; ZINC01845901; 1-isothiocyanatopentane; 629-12-9; n-Pentyl isothiocyanate | C6H11NS | 129.22 | CCCCCN=C=S |
| TCMBANKIN010686 | tsugaricacid a | C32H50O4 | 498.7 g/mol | CC(=CCCC(C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)C(=O)O)C | |
| TCMBANKIN010857 | ganode-8-en-ricacid lm2 | C30H42O7 | |||
| TCMBANKIN010861 | (5-butyl-3-oxo-2,3-dihydrofuran-2-yl)-aceticacid | C10H14O4 | 198.22 g/mol | CCCCC1=CC(=O)C(O1)CC(=O)O | |
| TCMBANKIN010875 | lanosta-7,9(11),24-trien-15α-acetoxy-3α-hy-droxy-23-oxo-26-oicacid | lanosta-7,9(11),24-trien-15α-acetoxy-3α-hydroxy-23-oxo-26-oic acid | C32H46O6 | 526.78 | |
| TCMBANKIN012240 | ganode-8-en-ricacid w | C34H52O7 | |||
| TCMBANKIN012697 | 4-methyl cyclohexanol | C7H14O | 114.19 | CC1CCC(CC1)O | |
| TCMBANKIN012721 | Diallyl | Hexadiene (DOT); alpha,omega-Hexadiene; .alpha.,.omega.-Hexadiene; 52440_FLUKA; EINECS 209-754-7; Biallyl; 128554_ALDRICH; 41919-05-5; 592-42-7; NSC 60690; NSC60690; InChI=1/C6H10/c1-3-5-6-4-2/h3-4H,1-2,5-6H; Hexa-1,5-diene; 1,5-Hexadiene | C6H10 | 82.14 | C=CCCC=C |
| TCMBANKIN013494 | sinampic acid | ||||
| TCMBANKIN013825 | ganodericacid b8 | C30H46O7 | 518.7 g/mol | CC(CC(=O)CC(C)C(=O)O)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)C)C)O | |
| TCMBANKIN014089 | (2S,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanoic acid | C6H12O7 | 196.16 | ||
| TCMBANKIN014153 | butylobetaine | ||||
| TCMBANKIN015284 | lucidenicacid c | C27H40O7 | 476.6 g/mol | CC(CCC(=O)O)C1CC(=O)C2(C1(C(C(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)O)C)C | |
| TCMBANKIN015666 | ganodericacidβ | C30H44O6 | |||
| TCMBANKIN016991 | lupulone | 3,5-dihydroxy-2-(3-methylbutanoyl)-4,6,6-tris(3-methylbut-2-enyl)cyclohexa-; CHEBI:134343; 5-hydroxy-2-(3-methylbutanoyl)-4,4,6-tris(3-methylbut-2-en-1-yl)-3-oxocyclohexa-1,5-dien-1-olate; lupulone(1-) | C26H38O4 | 414.58 | CC(C)CC(=O)C1=C(C(=C(C(C1=O)(CC=C(C)C)CC=C(C)C)O)CC=C(C)C)O |
| TCMBANKIN017633 | ganoderpurine iii | ||||
| TCMBANKIN017692 | methyl isothiocyanate | AC1L1WRD; DB-052769; TR-037081; Morton EP-161E; AKOS000119315; Trapexide; C18587; Metile isotiocianato [Italian]; Methyl isothiocyanate, 97%; Isothiocyanate de methyle [ISO-French]; (Methylimino)(thioxo)methane #; Isothiocyanate, polymer-bound; Isotiocianato de metilo [Spanish]; isothiocyanato-methane; Isotiocianato de metilo; CTK3I9993; Trapex; 89441-92-9; Methylisothiocyanaat [Dutch]; Methyl-isothiocyanat [German]; UN2477; AB1001507; (methylimino)thioxo-Methane; DSSTox_CID_7204; NCGC00254816-01; RTR-037081; Caswell No. 573; 31447-EP2295418A1; Vorlex (Nor-Am); Methyl isothiocyanate, polymer-supported, 1.5-1.9 mmol/g on polystyrene; Methyl-isothiocyanat; Methyl isothiocyanate [UN2477] [Poison]; Methyl thioisocyanate; Methylisothiocyanaat [Netherlands]; EINECS 209-132-5; CHEBI:78337; Methane, isothiocyanato-; methylimino(sulfanylidene)methane; Methylisothiocyanate polystyrene; DSSTox_GSID_27204; methylisothiocynate; Degussa methyl isothiocyanate; Methylsenfoel [German]; STK802388; Methylisothiokyanat [Czech]; methane isothiocyanate; TRA0079765; A830741; 33404-EP2311830A1; S09-0105; ZINC8830539; MFCD00004818; C2H3NS; methylimino(thioxo)methane; Methylsenfoel; NCGC00259097-01; CH3NCS; Methylisothiocyanat; (methylimino)(thioxo)-methane; methyl isothio-cyanate; Isothiocyanic acid, methyl ester; Methylisothiocyanat [Denmark]; methane, (methylimino)thioxo-; RWE2M5YDW1; 556-61-6; MCULE-6174235995; FT-0627523; Tox21_300912; LGDSHSYDSCRFAB-UHFFFAOYSA-N; UN 2477; X5315; methylimino-sulfanylidenemethane; Isothiocyanatomethane; NCGC00090735-03; Isothiocyanate de methyle; BB_SC-5863; InChI=1/C2H3NS/c1-3-2-4/h1H; 33404-EP2292606A1; MolPort-000-872-008; SC-27104; Trapex-40; LS-90049; Methyl isothiocyanate 10 microg/mL in Cyclohexane; methylisothiocyanate; Isotiocianato di metile [Italian]; ANW-32358; (Methylimino)(thioxo)methane; UNII-RWE2M5YDW1; NCGC00090735-04; 31447-EP2308858A1; WN 12; AI3-28257; NCGC00090735-01; 31447-EP2311816A1; METHYL ISOTHIOCYANATE; I0189; HSDB 6396; MeNCS; Isotiocianato di metile; CAS-556-61-6; Vortex; Tropex; Isothiocyanatomethane, 9CI; Tox21_201548; NCGC00090735-05; 31447-EP2274983A1; 31447-EP2311817A1; Isothiocyanate de methyle [French]; ACMC-1AYLJ; EPA Pesticide Chemical Code 068103; Biomet 33; Methyl isothiocyanate, PESTANAL(R), analytical standard; Isothiocyanate, polymer-bound, 100-200 mesh, extent of labeling: 1.0-2.0 mmol/g loading, 1 % cross-linked with divinylbenzene; Methyl mustard; EP-161E; AC1Q7EUL; BBL011120; Mitc; Vorlex 201 (Nor-Am); Methylisothiokyanat; Metile isotiocianato; Methylisothiocyanaat; Methyl isothiocyanate [UN2477] [Poison]; Methyl mustard oil; EC 209-132-5; DSSTox_RID_78348; AN-45905; Isothiocyanic Acid Methyl Ester; isothiocyanatomethyl; Methyl-isothiocyanate; 33404-EP2311815A1; isothiocyanatomethan; CHEMBL396000; F0001-1461; KS-00000VYZ; DTXSID2027204; Methyl isothiocyanate [BSI:ISO]; MFCD03457480; NCGC00090735-02 | C2H3NS | 73.12 g/mol | CN=C=S |
| TCMBANKIN017715 | isopropyl isothiocyanate | I0520; 2253-73-8; Isothiocyanic Acid Isopropyl Ester; ACMC-1CMAC; M-3652; AS04387; RT-003649; AC1L2OE3; isopropyl isothiocya; EINECS 218-851-3; CJ-07112; Propane, 2-isothiocyanato-; ANW-24911; J-801001; BB_SC-1843; MCULE-7689456429; isopropyl isothiocyanate, 95+%; DTXSID60177045; AN-50620; ipncs; 2-Isothiocyanatopropane #; CTK3J7230; ZINC1841344; KSC497E3B; U797; KB-52826; MFCD00037830; 2-Isothiocyanatopropane; 2-isothiocyanato-propane; FEMA 4425; OTAVA-BB 1055627; LABOTEST-BB LTBB003773; VHBFEIBMZHEWSX-UHFFFAOYSA-N; SBB056455; Isopropyl isothiocyanate; CHEMBL2208211; PubChem16501; SC-27133; BP-12933; UNII-46561PKP9T; propan-2-isothiocyanate; KS-00000EQF; BDBM50096277; BG00599861; F0001-0793; MolPort-000-147-099; AKOS000101197; isopropylisothiocyanate; J-802232; isothiocyanato-2-propane; AB0019471; KS-00001PQM; PROPANE, 2-ISOTHIOCYANATO; iso-propylisothiocyanate; Isopropyl isothiocyanate, 97%; TRA0055038; FT-0627465; 46561PKP9T; InChI=1/C4H7NS/c1-4(2)5-3-6/h4H,1-2H; S14-0848; ASISCHEM A85471; SCHEMBL213474; Isopropyl mustard oil; AC1Q7EUN; ST51047329; J-670002; iso-propyl isothiocyanate; AS-17372; Propane,2-isothiocyanato-; BBL027932 | C4H7NS | 101.17 g/mol | CC(C)N=C=S |
| TCMBANKIN018544 | 2,6,3-trimethyl-Dodecane | 212.47 | |||
| TCMBANKIN019889 | Myronate | beta-D-Glucopyranose, 1-thio-, 1-(N-(sulfooxy)-3-butenimidate); [1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylbut-3-enylideneamino] hydrogen sulfate; [1-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]thio]but-3-enylideneamino] hydrogen sulfate; [1-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]thio]but-3-enylideneamino] hydrogen sulfate; [1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]sulfanylbut-3-enylideneamino] hydrogen sulfate | C16H12O6 | 300.26 | C=CCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O |
| TCMBANKIN019913 | dl-3n-butylphthalide | (3R)-3-butyl-3H-isobenzofuran-1-one; (3R)-3-butyl-3H-2-benzofuran-1-one | C12H14O2 | 190.24 | |
| TCMBANKIN020705 | 2-isopropyl-5-methyl-hexyl-4-fork aldehyde | ||||
| TCMBANKIN020731 | ganode-8-en-ricacid d | C30H42O8 | |||
| TCMBANKIN020912 | lucidenicacid p | C29H42O8 | 518.6 g/mol | CC(CCC(=O)O)C1CC(=O)C2(C1(C(C(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)OC(=O)C)C)C | |
| TCMBANKIN021272 | ganode-8-en-ricacid dm | C30H44O4 | |||
| TCMBANKIN021677 | lucidenicacid lw1 | ||||
| TCMBANKIN021764 | Ganoderic acid T | ganoderic acid t; (E,5S,6S)-5-acetoxy-6-[(3R,5R,10S,13R,14R,15S,17R)-3,15-diacetoxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-hept-2-enoic acid; (E,5S,6S)-5-acetoxy-6-[(3R,5R,10S,13R,14R,15S,17R)-3,15-diacetoxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid; (E,5S,6S)-5-acetyloxy-6-[(3R,5R,10S,13R,14R,15S,17R)-3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid; (E,5S,6S)-5-acetyloxy-6-[(3R,5R,10S,13R,14R,15S,17R)-3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-hept-2-enoic acid | C36H52O8 | 612.79 | CC(C1CC(C2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)OC(=O)C)C(CC=C(C)C(=O)O)OC(=O)C |
| TCMBANKIN022319 | ganoderic acid Mc | AC1NSVPD; 2-methyl-4-oxo-6-(3,7,15-trihydroxy-4,4,10,13,14-pentamethyl-11-oxo-1,2,3,5,6,7,8,9,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)heptanoic acid | C36H54O9 | 630.81 | CC(C1CC(C2(C1(CCC3=C2C(CC4C3(CCC(C4(C)C)OC(=O)C)C)OC(=O)C)C)C)O)C(CC=C(C)C(=O)O)OC(=O)C |
| TCMBANKIN022438 | 3-Butynol | 927-74-2; 4-Hydroxy-1-butyne; 2-Hydroxyethylacetylene; NSC9708; ZINC01700120; buta-1,3-diyn-1-ol; 4-01-00-02219 (Beilstein Handbook Reference); InChI=1/C4H6O/c1-2-3-4-5/h1,5H,3-4H; BRN 0773710; But-3-yn-1-ol; 3-Butyne-1-ol; 130850_ALDRICH; 3-Butyn-1-ol; WLN: Q3UU1; AI3-25453; NSC 9708; 19195_FLUKA; 1-Butyn-4-ol; 3-Butynyl alcohol; EINECS 213-161-9; C06146 | C4H6O | 70.09 | C#CCCO |
| TCMBANKIN024224 | ganoderic acid df | C30H44O7 | 516.7 g/mol | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(CC(C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)O)C)C | |
| TCMBANKIN024456 | i-Butyl isothiocyanate | BB_SC-1844; EINECS 209-733-2; Propane, 1-isothiocyanato-2-methyl- (9CI); 4-04-00-00653 (Beilstein Handbook Reference); ZINC01846032; 2-Methylpropyl isothiocyanate; Isothiocyanic acid, isobutyl ester; 1-Isothiocyanato-2-methylpropane; 1-isothiocyanato-2-methyl-propane; Isobutyl isothiocyanate; BRN 1740371; Propane, 1-isothiocyanato-2-methyl-; 591-82-2 | C5H9NS | 115.2 | CC(C)CN=C=S |
| TCMBANKIN024508 | 4-phemyl-2-butanone | ||||
| TCMBANKIN025169 | Garbanzol | 1226-22-8; SCHEMBL9663852; (2R,3R)-3,7-dihydroxy-2-(4-hydroxyphenyl)-4-chromanone; AC1MR5CU; C09751; (2R,3R)-3,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one; 3,7,4'-Trihydroxyflavanone; garbanzol; 3,7,4'-Trihydroxyflavanon; 3,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one; 3,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one; (2R,3R)-3,4',7-Trihydroxyflavanone | C15H12O5 | 272.25 | C1=CC(=CC=C1C2C(C(=O)C3=C(O2)C=C(C=C3)O)O)O |
| TCMBANKIN025676 | 24- methyl cholestane-7, 22- diene-3β- alcohol | ||||
| TCMBANKIN025806 | Phenyl isothiocyanate | Phenyl isothiocyanate, reagent grade, 98%; Ylothane; PHENYL ISOTHIOCYANATE; CCRIS 3144; I0191; phenyl-isothiocyanate; iso-thiocyana-tobenaene; WLN: SCNR; RP20215; SC-25756; Jsp000376; ZB008168; AKOS000119287; PITC; PubChem18702; NSC5583; AM90356; Phenyl isothiocyanate, for HPLC derivatization, the detection of alcohols and amines, >=99.0%; TIMTEC-BB SBB040940; MCULE-4369838098; benzene, isothiocyanato; 30342-EP2311817A1; 71255-EP2295418A1; CAS-103-72-0; 30342-EP2311464A1; ST50214555; SCHEMBL20984; AKOS BBS-00004438; 30342-EP2311816A1; TRA0069149; InChI=1/C7H5NS/c9-6-8-7-4-2-1-3-5-7/h1-5; F2121-0322; Fenylisothiokyanat [Czech]; I01-1988; KS-00000V7I; phenyl isothio-cyanate; RTR-000864; 103-72-0; AI3-09310; DTXSID0021129; KSC492K1J; A800790; NSC-5583; KB-59552; phenyl isothiocynate; J-802269; CJ-02152; UNII-0D58F84LSU; AC1L1PAO; Phenyl isothiocyanate solution; MFCD00004798; Benzene,isothiocyanato-; AS04391; phenylisothiocynate; 4-12-00-00867 (Beilstein Handbook Reference); CHEMBL309036; Phenylsenfoel; QKFJKGMPGYROCL-UHFFFAOYSA-N; OTAVA-BB 1055672; Phenyl isothiocyanate, 97% 100g; phenyl isothiocyanate; BBL027476; TR-000864; EINECS 203-138-1; CHEBI:85103; 1-Isothiocyanatobenzene; BRN 0471392; isothiocyanato-benzen; Phenyl thioisocyanate; NCGC00258680-01; Fenylisothiokyanat; USAF M-4; J-801008; 71255-EP2308833A2; Phenyl isothiocyanate solution, 5% in heptane; R522; 30342-EP2308858A1; BDBM50073665; ZINC164500; Tox21_201128; isothiocynato benzene; Phenylisothiocyanate; STL281854; NCGC00248931-01; Phenyl mustard oil; EN300-17278; C7H5NS; DSSTox_RID_75960; Phenyl isothiocyanate, Sigma Grade, 8.36 M, suitable for solid phase protein sequencing analysis, >=99% (GC), liquid; Phenyl isothiocyanate, for protein sequence analysis, >=99.5% (GC); J-523934; CTK3J2514; AN-24653; MolPort-000-145-939; DSSTox_GSID_21129; EDMAN'S REAGENT; Phenyl isothiocyanate, 99%, for protein sequencing; ACMC-20ajx2; Isothiocyanato-benzene; phenyisothiocyanate; Isothiocynatobenzene; LS-7649; Isothiocyanic acid phenyl ester; Phenyl sothocyanate; 0D58F84LSU; FT-0627519; 30342-EP2284157A1; BB_SC-9412; Benzene-1-isothiocyanate; DSSTox_CID_1129; Phenylsenfoel [German]; AC1Q7EXY; SBB040940; Thiocarbanil; CS-B1640; AC1Q7EXX; Phenyl isothiocyanate solution, for protein sequence analysis, ~5% in heptane; NE10354; Benzene, isothiocyanato-; Isothiocyanatobenzene; NSC 5583; Isothiocyanic acid, phenyl ester | C7H5NS | 135.19 | C1=CC=C(C=C1)N=C=S |
| TCMBANKIN025905 | Proliferin | proliferin | C27H40O5 | 444.6 g/mol | CC1=CCCC(=CCC2(C(CC=C(C(CC1)O)C)C(=C(C2=O)O)C(C)COC(=O)C)C)C |
| TCMBANKIN026554 | 3-Butenyl isothiocyanate | 1-Butene, 4-isothiocyanato-; LS-86393; 4-isothiocyanatobut-1-ene; ZINC02556931; CHEMBL2251722; but-3-enylimino-thioxo-methane; AC1O5S8A; 3386-97-8; Butenylisothiocyanat; (1E)-1-ISOTHIOCYANATOBUT-1-ENE; Butenyl isothiocyanate; 3-butenyl isothiocyanate; EINECS 222-209-8; (E)-1-isothiocyanatobut-1-ene; Butenylisothiocyanate; Butenylisothiocyanat [German]; Isothiocyanic acid, butenyl ester | C5H7NS | 113.18 | CCC=CN=C=S |
| TCMBANKIN027223 | lucidenicacid f | C27H36O6 | 456.6 g/mol | CC(CCC(=O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(=O)CC4C3(CCC(=O)C4(C)C)C)C)C | |
| TCMBANKIN028529 | ganodermicacid s | C34H50O6 | 554.8 g/mol | CC(CCC=C(C)C(=O)O)C1CC(C2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)OC(=O)C | |
| TCMBANKIN028899 | (+)-(Z)-Methyl epijasmonate | methyl 2-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]ethanoate; methyl 2-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetate; 2-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid methyl ester; 2-[(1S,2S)-3-keto-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid methyl ester | C13H20O3 | 224.3 g/mol | CCC=CCC1C(CCC1=O)CC(=O)OC |
| TCMBANKIN029374 | 1-(1-Methyl thiopropyl)-1-propenyl disulfide | AC1NSYM7; 1-methylsulfanyl-1-(prop-1-enyldisulfanyl)propane; 1-(1-methyl thiopropyl)-1-propenyl disulfide | C7H14S3 | 194.42 | CCC(SC)SSC=CC |
| TCMBANKIN029592 | ganoderic acid Ma | Ganoderenic Acid A; ganoderic acid ma; BDBM50359036; FT-0082743; 907G622; CHEMBL1922171 | C34H52O7 | 572.77 | CC(CC(=O)C=C(C)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C)O)C(=O)O |
| TCMBANKIN030544 | ganode-8-en-ricacid h | C32H44O9 | |||
| TCMBANKIN030580 | ganode-8-en-ricacid v | C32H48O6 | |||
| TCMBANKIN032162 | ergotamine | C33H35N5O5 | 581.7 g/mol | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | |
| TCMBANKIN032532 | 3β-oxo-formyl-7β,12β-dihydroxy-4,4,14α-tri-methyl-5α-chol-11,15-dioxo-8-en(e)-24-oicacid | ||||
| TCMBANKIN033425 | ricinoleic acid | 12-hydroxyoleate; ricinoleicacid; 12-hydroxy-(9Z)-octadecenoate; (9Z)-12-hydroxyoctadec-9-enoate; CHEBI:85150 | C18H34O3 | 298.46 | CCCCCCC(CC=CCCCCCCCC(=O)[O-])O |
| TCMBANKIN033548 | 3-Methylbutyl isothiocyanate | 1-Isothiocyanato-3-methylbutane; Butane, 1-isothiocyanato-3-methyl-; 628-03-5; 1-isothiocyanato-3-methyl-butane; ZINC02528121 | C6H11NS | 129.22 | CC(C)CCN=C=S |
| TCMBANKIN034035 | lanosta-7,9(11),24-trien-3α-acetoxy-15α,22β-dihydroxy-26-oicacid | C32H48O5 | |||
| TCMBANKIN034397 | Methyl ganoderate I | methyl ganoderate i; methyl (Z)-6-[(10S,13R,17S)-3,15-dihydroxy-4,4,10,13,14,17-hexamethyl-7,11-dioxo-1,2,3,5,6,12,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxohept-5-enoate; AC1NSYEJ | C31H46O8 | 546.69 | CC(CC(=O)C=C(C)C1(CC(C2(C1(CC(=O)C3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)C)C)O)C)C(=O)OC |
| TCMBANKIN034597 | lanosta-7,9(11),24-trien-3α-acetoxy-15α-hy-droxy-23-oxo-26-oicacid | lanosta-7,9(11),24-trien-3α-acetoxy-15α-hydroxy-23-oxo-26-oic acid | C32H46O6 | 526.78 | |
| TCMBANKIN034776 | ganode-8-en-ricacid u | C30H48O4 | |||
| TCMBANKIN035504 | ganode-8-en-ricacid ma | C34H52O7 | |||
| TCMBANKIN035599 | sec-butyl isothiocyanate | UNII-126JI237AW component TUFJIDJGIQOYFY-RXMQYKEDSA-N; ZINC167189; (2R)-2-isothiocyanatobutane; AC1NUCKH; A826523; [R,(?)]-2-Isothiocyanatobutane; ZB008778 | C5H9NS | 115.2 g/mol | CCC(C)N=C=S |
| TCMBANKIN036722 | ganode-7,9-dien-ricacid x | C32H48O5 | |||
| TCMBANKIN037023 | (24S)-Methyl cholest-8(14)-enol | ||||
| TCMBANKIN037423 | Butyl isthiocyanate | butyl isthiocyanate | 129.25 | ||
| TCMBANKIN037685 | Lucialdehyde B | 480439-84-7; CHEBI:66593; ZINC38562918; CHEMBL463372; lucialdehyde b; (24E)-3,7-dioxolanosta-8,24-dien-26-al; lucialdehyde B | C30H44O3 | 453 | C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C(C([H])([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])([C@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])\C([H])=C(\C([H])=O)/C([H])([H])[H])C([H])([H])C2([H] )[H])[C@@]23C([H])([H])[H])=C3C(=O)C4([H])[H])[C@@]4([H])C(C([H])([H])[H])(C([H])([H])[H])C1=O |
| TCMBANKIN037993 | Lucidenic acid B | lucidenicacid b | 474.59 | ||
| TCMBANKIN038083 | 20-Hydroxylganoderic acid G | 20-hydroxylganodericacid g; (3beta,7beta,12beta,20R)-3,7,12,20-tetrahydroxy-11,15,23-trioxolanost-8-en-26-oic acid; (2S,6S)-6-hydroxy-2-methyl-4-oxo-6-[(3S,5R,7S,10S,12S,13R,14R,17S)-3,7,12-trihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]heptanoic acid; InChI=1/C30H44O9/c1-14(25(37)38)10-15(31)13-28(5,39)18-12-20(34)30(7)21-16(32)11-17-26(2,3)19(33)8-9-27(17,4)22(21)23(35)24(36)29(18,30)6/h14,16-19,24,32-33,36,39H,8-13H2,1-7H3,(H,37,38)/t14?,16-,17-,18+,19-,24+,27-,28+,29-,30-/m0/s; 6-Hydroxy-2-methyl-4-oxo-6-(3,7,12-trihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,4,5,6,7,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-heptanoic acid; (2S,6S)-6-hydroxy-4-keto-2-methyl-6-[(3S,5R,7S,10S,12S,13R,14R,17S)-3,7,12-trihydroxy-11,15-diketo-4,4,10,13,14-pentamethyl-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]enanthic acid | C30H44O9 | 549 | C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C(C(=O)[C@@]([H])(O[H])[C@](C([H])([H])[H])([C@@]([H])([C@@](O[H])(C([H])([H])C(=O)C([H])([H])[C@]([H])(C(O[H])=O)C([H])([H])[H])C([H])([H])[H])C([H])([H])C 2=O)[C@@]23C([H])([H])[H])=C3[C@@]([H])(O[H])C4([H])[H])[C@]4([H])C(C([H])([H])[H])(C([H])([H])[H])[C@@]1([H])O[H] |
| TCMBANKIN038117 | Methyl lucidenate E2 | methyl lucidenate e2; NSC726131; NSC-726131 | 530.6 g/mol | ||
| TCMBANKIN038787 | methyl lucidenate l | C28H40O7 | 488.6 g/mol | CC(CCC(=O)OC)C1CC(=O)C2(C1(C(C(=O)C3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)O)C)C | |
| TCMBANKIN039340 | 3,5-Octadiene-2-one | 124.18 g/mol | |||
| TCMBANKIN039349 | Ganoderic acid E | ganodericacid e | 512.63 | ||
| TCMBANKIN039635 | Lucidumol A | lucidumol a | C30H48O4 | 472.7 | CC(CCC(C(C)(C)O)O)C1CCC2(C1(CCC3=C2C(=O)CC4C3(CCC(=O)C4(C)C)C)C)C |
| TCMBANKIN039688 | Lucidone B | lucidone b | 400.51 | ||
| TCMBANKIN040058 | Ganolactone | C27H36O6; AC1NSVQY; (5R,7S,10S,13R,14R,17S)-7-hydroxy-4,4,10,13,14-pentamethyl-17-(2-methyl-5-oxooxolan-2-yl)-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthrene-3,11,15-trione; BG01160314; (1S,3AR,4S,5AR,9AS,11AR)-4-HYDROXY-3A,6,6,9A,11A-PENTAMETHYL-1-(2-METHYL-5-OXOOXOLAN-2-YL)-1H,2H,4H,5H,5AH,8H,9H,11H-CYCLOPENTA[A]PHENANTHRENE-3,7,10-TRIONE; 9346AF | C27H36O6 | 456.6 g/mol | C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C(C(=O)C([H])([H])[C@](C([H])([H])[H])([C@@]([H])([C@]2(C([H])([H])C([H])([H])C(=O)O2)C([H])([H])[H])C([H])([H])C3=O)[C@@]34C([H])([H])[H])=C4[C@@]([H])(O[H ])C5([H])[H])[C@]5([H])C(C([H])([H])[H])(C([H])([H])[H])C1=O |
| TCMBANKIN040077 | lucidenic acid G | lucidenicacid g | C27H40O7 | 476.6 | CC(CCC(=O)O)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)CO)C)O)C)C)O |
| TCMBANKIN040230 | Ganoderic acid DM | ganoderic acid dm | C30H44O4 | 468.67 | CC(CCC=C(C)C(=O)O)C1CCC2(C1(CCC3=C2C(=O)CC4C3(CCC(=O)C4(C)C)C)C)C |
| TCMBANKIN040522 | Ganoderic acid I | ganodericacid i | 532.67 | ||
| TCMBANKIN040584 | Methyl lucidenate P | methyl lucidenate p | 532.67 | ||
| TCMBANKIN041272 | stearic acid | 4-02-00-01206 (Beilstein Handbook Reference); AIDS-049230; Emersol 871; 8039-52-9; 126539-56-8; stearic acid, ion(1-); D00119; octadecoic acid; Hydrofol Acid 150 (VAN); 134503-33-6; Fatty acids C16-18; 68937-76-8; Kam 2000; VLZ 200; Lunac S 98; Glycon S-80; Hy-phi 1205; Lunac YA; Pristerene 9429; Pristerene 4900; Octadecanoic acid (9CI); Hystrene 9718NF; Edenor FHTI; Cetylacetic acid; NAA 173; NSC 25956; Lunac S 90; S 30C S 30C (fatty acid); Neo-Fat 18-61; Dar-chem 14; NSC25956; Edenor HT-JG 60; Octadecanoate; 57485-56-0; Oktadekansaeure; S 300 (fatty acid); Unister NAA 180; Industrene 5016; Prisorine 3508; Hydrofol Acid 150; Hystrene 4516; G 270; Stearic Acid Cherry; Century 1230; 822-16-2 (SODIUM SALT); NCGC00091596-02; Glycon S-90; 85404-83-7; NCGC00091596-01; Stearic acid (JP15/NF); Hystrene 5016; Hy-phi 1303; Glycon S-70; C01530; Octadecansaeure; Neo-Fat 18-55; WO 2 (fatty acid); Pristerene 9559; SA 200; Century 1240; Stearic acid, pure; Sunfat 18S; WO 2; CHEBI:28842; Industrene 5016K; LS-2392; Kam 3000; BRN 0608585; Edenor ST 20; AIDS049230; Lunac 30; EINECS 273-087-8; Emersol 150; 175366_SIAL; 8039-54-1; Fatty acids, C16-20; stearicacid; Stearic acid ion(1-)salt; Stearic acid (8CI); Stearinsaeure; Emersol 153NF; Hydrofol acid 1855; 57-11-4; Lunac S 30; Hystrene T 70; Prisorine 3501; Haimaric MKH(R); Stearex Beads; Groco 55; Hystrene S-97; Neo-Fat 18-54; W303518_ALDRICH; Hydrofol acid 1655; Nonsoul SN 1 (*Sodium salt*); EINECS 200-313-4; 39390-61-9; Emersol 120; EPA Pesticide Chemical Code 079082; Lunac S 20; Octadecanoic acid, ion(1-); 8013-28-3; AI3-00909; Kortacid 1895; FEMA No. 3035; Hystrene S 97; 82497-27-6; Tegostearic 254; SNA-2000 (*Sodium salt*); 1-Heptadecanecarboxylic acid; AC1MHWEJ; STL280244; 27405_RIEDEL; Steric acid; Industrene 9018; Glycon dp; F 3 (lubricant); Hy-phi 1401; Lunac S 50; Emersol 132; Stearic acid, ion(1-) (8CI); CH3-[CH2]16-COO(-); acide octadecanoique; Groco 55l; 73297_FLUKA; Serfax MT 90; Stearic acid [USAN:JAN]; 8039-51-8; acide stearique; Kam 1000; Acidum stearinicul; InChI=1/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20; 8039-53-0; 17FA; Stearophanic acid; 8037-83-0; Hystrene 7018; FA 1655; Prisorine 3502; Nonsoul SK 1; Hydrofol Acid 1895; Lunac S 40; Stearic acid 50; 8023-06-1; 85679_FLUKA; HSDB 2000; n-Octadecanoate; 400JB9103-88; Glycon tp; Unimac 5680; Loxiol G 20; Stearate; 875D; Octadecanoic acid; Neo-Fat 18-53; octadecanoate (n-C18:0); Radiacid 0427; Emery 871; Vanicol; Vis-Plus; PD 185; EINECS 250-178-0; AKOS022105769; 646-29-7; Edenor ST 1; S 300; Caswell No. 801D; Selosol 920; Tegostearic 272; Isostearic acid EX; A 1760; WLN: QV17; Stearic acid (TN); Pearl stearic; 609343-71-7; Palmitic acid - stearic acid mixture; Emersol 875; Industrene 8718; Hystrene 9718NFFG; NCGC00164255-02; ST023799; LMFA01010018; Groco 54; Edenor C18; Hystrene T-70; Hy-phi 1199; CTK8J8420; n-Octadecanoic acid; Groco 58; Pristerene 4963; Formula 300; AFCO-Chem B 65; CCRIS 2305; Industrene R; Century 1220; S4751_SIGMA; Neo-Fat 18; 58392-66-8; Barolub FTA; Hystrene 9718; CH3-[CH2]16-COOH; STE; 8037-40-9; 30399-84-9; Lunac S 90KC; Hydrofol 1895; Emery 875D; Century 1210; QIQXTHQIDYTFRH-UHFFFAOYSA-M; Neo-Fat 18-59; LS-1388; Groco 59; Humko Industrene R; Hystrene 80; Adeka Fatty Acid SA 910; Stearic acid; Prifac 2918; Emersol 6349; Edenor C 18/98; 3uex; LS-97707; CHEBI:25629; Neo-Fat 18-S; Stearic acid - palmitic acid mixture; Tegostearic 255; C-Lube 10 | C18H36O2 | 284 | C([H])([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C(O[H])= O |
| TCMBANKIN041813 | Ganoderiol F | (5R,10S,13R,14R,17R)-17-[(1R)-6-hydroxy-5-(hydroxymethyl)-1-methylhex-4-enyl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one; ganoderiol f; AIDS-070765; AIDS070765; 114567-47-4; (5R,10S,13R,14R,17R)-17-[(2R)-7-hydroxy-6-(hydroxymethyl)hept-5-en-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one; (5R,10S,13R,14R,17R)-17-[(1R)-6-hydroxy-1-methyl-5-methylol-hex-4-enyl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one; 26,27-Dihydroxylanosta-7,9(11),24-trien-3-one; (5R,10S,13R,14R,17R)-17-[(1R)-6-hydroxy-5-(hydroxymethyl)-1-methyl-hex-4-enyl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one | 455 | ||
| TCMBANKIN041940 | gluconasturtiin | GNST; 2-phenylethyl-glucosinolate | C15H21NO9S2 | 423.5 g/mol | C1=CC=C(C=C1)CCC(=NOS(=O)(=O)O)SC2C(C(C(C(O2)CO)O)O)O |
| TCMBANKIN042114 | Ganosporelactone A | ganosporelactone a | C30H40O7 | 512.63 | C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C(C(=O)[C@@]([H])(O[H])[C@](C([H])([H])[H])([C@]2([H])[C@@]([H])([C@@]3(C([H])([H])[C@@]([H])(C([H])([H])[H])C(=O)O3)C([H])([H])[C@@]2([H])C([H])([H])[H])C4 =O)[C@@]45C([H])([H])[H])=C5[C@@]([H])(O[H])C6([H])[H])[C@]6([H])C(C([H])([H])[H])(C([H])([H])[H])C1=O |
| TCMBANKIN042151 | ergosterol peroxide | ergosterol peroxide; 2061-64-5; ergosterolperoxide; dimethyl-[(E,1R,4R)-1,4,5-trimethylhex-2-enyl][?]ol; (3.beta.,5.alpha.,8.alpha.,22E)-5,8-Epidioxyergosta-6,22-dien-3-ol | C56H86O2 | 791 | O([C@]1([H])C([H])([H])C([C@@](C([H])([H])[H])([C@]([H])(C([H])([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])([C@]([H])(C([H])([H])[H])\C([H])=C([H])\[C@@]([H])(C([H])(C([H])([H])[H])C([H])([H])[H])C ([H])([H])[H])C([H])([H])C2([H])[H])[C@]23[H])C3=C4[H])C([H])([H])C1([H])[H])=C4[H])O[C@]5([H])C([H])([H])C([C@@](C([H])([H])[H])([C@]([H])(C([H])([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])([C@]([ H])(C([H])([H])[H])\C([H])=C([H])\[C@@]([H])(C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])C6([H])[H])[C@]67[H])C7=C8[H])C([H])([H])C5([H])[H])=C8[H] |
| TCMBANKIN042273 | Ganodermic acid R | ganodermicacid r; (Z,6R)-6-[(3R,5R,10S,13R,14R,15S,17R)-3,15-diacetoxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-hept-2-enoic acid; (Z,6R)-6-[(3R,5R,10S,13R,14R,15S,17R)-3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid; (Z,6R)-6-[(3R,5R,10S,13R,14R,15S,17R)-3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-hept-2-enoic acid; (Z,6R)-6-[(3R,5R,10S,13R,14R,15S,17R)-3,15-diacetoxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid | C30H42O8 | 530.65 | CC(CCC=C(C)C(=O)O)C1CC(C2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)OC(=O)C |
| TCMBANKIN042621 | lucidenic acid D1 | lucidenicacid d1 | C27H34O7 | 470.55 | CC(CCC(=O)O)C1CC(=O)C2(C1(C(=O)C(=O)C3=C2C(=O)CC4C3(CCC(=O)C4(C)C)C)C)C |
| TCMBANKIN042639 | 8beta,9alpha-Dihydroganoderic acid J | 8β,9α-dihydroganodericacid j | C30H44O7 | 516.67 | CC(CC(=O)CC(C)C(=O)O)C1CC(C2(C1(CC(=O)C3C2C(=O)CC4C3(CCC(=O)C4(C)C)C)C)C)O |
| TCMBANKIN042688 | N-Phenyl-2-naphthalene amine | 2-phenyl-isoquinoline; AC1NSZLC; SCHEMBL1553150; SCXBFXGVOQYURB-UHFFFAOYSA-N; 2-phenylisoquinoline; 2-phenyl-1H-isoquinoline; 2-Phenyl-1,2-dihydroisoquinoline | C15H13N | 207.27 | c1([H])c([H])c(C([H])([H])N(c2c([H])c([H])c([H])c([H])c2[H])C([H])=C3[H])c3c([H])c1[H] |
| TCMBANKIN042711 | ganoderiol D | ganoderiol d; AC1NSVQG; 4,4,10,13,14-pentamethyl-17-[(5R,6R)-5,6,7-trihydroxy-6-methylheptan-2-yl]-2,5,6,11,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,7-dione | C30H48O5 | 488.7 | CC(CCC(C(C)(CO)O)O)C1CCC2(C1(CCC3=C2C(=O)CC4C3(CCC(=O)C4(C)C)C)C)C |
| TCMBANKIN042911 | Lucialdehyde C | lucialdehyde c | C30H46O3 | 454.68 | CC(CCC=C(C)C=O)C1CCC2(C1(CCC3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)C)C |
| TCMBANKIN043317 | Ganolucidic acid B | ganolucidicacid b | 502.68 | ||
| TCMBANKIN043384 | methyl ganoderate F | methyl ganoderate f | C33H44O9 | 585 | C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C(C(=O)[C@@]([H])(OC(C([H])([H])[H])=O)[C@](C([H])([H])[H])([C@@]([H])([C@@]([H])(C([H])([H])C(=O)C([H])([H])[C@]([H])(C(OC([H])([H])[H])=O)C([H])([H])[H])C ([H])([H])[H])C([H])([H])C2=O)[C@@]23C([H])([H])[H])=C3C(=O)C4([H])[H])[C@]4([H])C(C([H])([H])[H])(C([H])([H])[H])C1=O |
| TCMBANKIN043645 | Lucidone A | (3S,5R,7S,10S,13R,17S)-17-acetyl-3,7-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthrene-11,15-dione; lucidone a; AC1L44B5 | 402.52 | ||
| TCMBANKIN043692 | Ganolucidic acid A | ganolucidicacid a; Lanost-8-en-26-oic acid, 15-hydroxy-3,11,23-trioxo-, (15.alpha.,25R)-; (2R,6R)-6-[(5R,10S,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxo-heptanoic acid; AIDS085921; (2R,6R)-6-[(5R,10S,13R,14R,15S,17R)-15-hydroxy-3,11-diketo-4,4,10,13,14-pentamethyl-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-4-keto-2-methyl-enanthic acid; 98665-21-5; Lanost-8-en-26-oic acid, 15-hydroxy-3,11,23-trioxo-, (15alpha,25R)-; AIDS-085921; (2R,6R)-6-[(5R,10S,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid | C30H44O6 | 500.67 | CC(CC(=O)CC(C)C(=O)O)C1CC(C2(C1(CC(=O)C3=C2CCC4C3(CCC(=O)C4(C)C)C)C)C)O |
| TCMBANKIN043933 | progoitrin | R-2-Hydroxy-3-butenyl glucosinolate | C11H19NO10S2 | 389.399 | O1[C@@]([H])(C([H])([H])O[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]1([H])S\C(\C([H])([H])[C@]([H])(O[H])C([H])=C([H])[H])=N/OS(O)(=O)=O |
| TCMBANKIN044284 | ganosporelactone B | ganosporelactone b | C30H42O7 | 514.65 | CC1CC2(CC(C(=O)O2)C)C3C1C4(C(C(=O)C5=C(C4(C3=O)C)C(CC6C5(CCC(C6(C)C)O)C)O)O)C |
| TCMBANKIN044351 | methyl lucidenate A | AVSUQFFHBSVWRI-NZXXOGSYSA-; METHYL LUCIDENATE A; InChI=1/C28H40O6/c1-15(8-9-22(33)34-7)16-12-21(32)28(6)24-17(29)13-19-25(2,3)20(31)10-11-26(19,4)23(24)18(30)14-27(16,28)5/h15-17,19,29H,8-14H2,1-7H3/t15-,16-,17+,19+,26+,27-,28+/m1/s1; CHEMBL460970 | C28H40O6 | 473 | C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C(C(=O)C([H])([H])[C@](C([H])([H])[H])([C@@]([H])([C@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])C(OC([H])([H])[H])=O)C([H])([H])C2=O)[C@@]23C([H])([H])[H]) =C3[C@@]([H])(O[H])C4([H])[H])[C@]4([H])C(C([H])([H])[H])(C([H])([H])[H])C1=O |
| TCMBANKIN044557 | Methyl lucidenate F | 470.6 g/mol | |||
| TCMBANKIN045051 | Lucialdehyde A | lucialdehyde a | C30H46O2 | 438.68 | CC(CCC=C(C)C=O)C1CCC2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)O)C)C)C |
| TCMBANKIN045140 | Ergosta-7,22-dien-3β-yl pentadecanoate | ||||
| TCMBANKIN045166 | Lucidenic acid H | lucidenicacid h | 476.6 | ||
| TCMBANKIN045864 | Ganodermanontriol | 472.7 g/mol | |||
| TCMBANKIN045930 | Sinapine | 18696-26-9; AK676101; ZINC1532786; C00933; Ethanaminium, 2-((3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl)oxy)-N,N,N-trimethyl-; 2-((3-(4-Hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl)oxy)-N,N,N-trimethylethanaminium; AC1Q65Q4; Sinapine bisulphate; sinapic acid choline ester; 09211A0HHL; ACon1_000255; 2-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyloxy]-N,N,N-trimethylethanaminium; UNII-09211A0HHL; MCULE-2468175287; Q-100224; O-sinapoylcholine; CHEBI:16353; AC1NQWZ5; 2-((3-(4-Hydroxy-3,5-dimethoxyphenyl)acryloyl)oxy)-N,N,N-trimethylethanaminium; BRD-K21295184-064-01-0; 2-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxyethyl-trimethylazanium; 4-Hydroxy-3,5-dimethoxycinnamate choline; BG01022959; MEGxp0_001763; AKOS030626997; C16H24NO5; DTXSID10171957; Sinapoylcholine; Ethanaminium,2-[[3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propen-1-yl]oxy]-N,N,N-trimethyl-; Sinapine; 8262AH; sinapoylcholine; sina-pine; 2-(4-hydroxy-3,5-dimethoxycinnamoyloxy)-N,N,N-trimethylethanaminium; MolPort-019-904-083 | C17H25N2O5S | 370 | O(C(=O)\C([H])=C([H])\c1c([H])c(OC([H])([H])[H])c(O[H])c(OC([H])([H])[H])c1[H])C([H])([H])C([H])([H])N(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H].N#CS |
| TCMBANKIN045938 | lucidenic acid I | lucidenicacid i | C27H38O7 | 474.59 | CC(CCC(=O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(=O)CC4C3(CCC(C4(C)CO)O)C)C)C |
| TCMBANKIN045962 | Lucidenic acid L | lucidenicacid l | 474.59 | ||
| TCMBANKIN046146 | Lucidenic acid E1 | lucidenicacid e1 | 474.59 | ||
| TCMBANKIN046228 | methyl lucidenate q | C28H42O6 | 474.6 g/mol | CC(CCC(=O)OC)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C)O | |
| TCMBANKIN046311 | lucidenic acid D2 | (4R)-4-[(5R,10S,12S,13R,14R,17R)-12-acetoxy-3,7,11,15-tetraketo-4,4,10,13,14-pentamethyl-2,5,6,12,16,17-hexahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid; 98665-16-8; NSC733508; (4R)-4-[(5R,10S,12S,13R,14R,17R)-12-acetoxy-4,4,10,13,14-pentamethyl-3,7,11,15-tetraoxo-2,5,6,12,16,17-hexahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid; (4R)-4-[(5R,10S,12S,13R,14R,17R)-12-acetyloxy-4,4,10,13,14-pentamethyl-3,7,11,15-tetraoxo-2,5,6,12,16,17-hexahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid; lucidenicacid d2; Chol-8-en-24-oic acid, 12-(acetyloxy)-4,4,14-trimethyl-3,7,11,15-tetraoxo-, (5.alpha.,12.beta.) | C29H38O8 | 515 | C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C(C(=O)[C@@]([H])(OC(C([H])([H])[H])=O)[C@](C([H])([H])[H])([C@@]([H])([C@@]([H])(C([H])([H])C([H])([H])C(O[H])=O)C([H])([H])[H])C([H])([H])C2=O)[C@@]23C([H ])([H])[H])=C3C(=O)C4([H])[H])[C@]4([H])C(C([H])([H])[H])(C([H])([H])[H])C1=O |
| TCMBANKIN046535 | Lucidenic acid K | lucidenicacid k | 472.57 | ||
| TCMBANKIN046622 | Ganoderiol A | ganoderiol a; AC1NSVQA; (2R)-2-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylheptane-1,5,6-triol | C30H50O4 | 475 | C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C(=C([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])([C@@]([H])(C([H])([H])C([H])([H])[C@]([H])(O[H])[C@@](C([H])([H])O[H])(C([H])([H])[H])O[H])C([H])([H])[H ])C([H])([H])C2([H])[H])[C@@]23C([H])([H])[H])C3=C([H])C4([H])[H])[C@@]4([H])C(C([H])([H])[H])(C([H])([H])[H])[C@@]1([H])O[H] |
| TCMBANKIN046626 | ganodine | ZINC6096242; 1H-Pyrrole-2-carboxaldehyde, 5-(hydroxymethyl)-1-(2-phenylethyl)-; AC1L2QJ0; DTXSID00157947; N-Phenylethyl-2-formyl-5-hydroxymethylpyrrole; Ganoderma alkaloid B; KB-243876; 5-(hydroxymethyl)-1-phenethylpyrrole-2-carbaldehyde; N-Phenylethyl-5-hydroxymethylpyrryl aldehyde; 133086-81-4; Ganodine; 5-(HYDROXYMETHYL)-1-(2-PHENYLETHYL)PYRROLE-2-CARBALDEHYDE | C14H15NO2 | 229.27 g/mol | C1=CC=C(C=C1)CCN2C(=CC=C2C=O)CO |
| TCMBANKIN046701 | Ganodermanondiol | ( )-Ganodermanondiol; (5R,10S,13R,14R,17R)-17-[(1R,4S)-4,5-dihydroxy-1,5-dimethylhexyl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one; (5R,10S,13R,14R,17R)-17-[(1R,4S)-4,5-dihydroxy-1,5-dimethyl-hexyl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one; ganodermanondiol; 107900-76-5; AIDS-085920; AIDS085920; CHEMBL1098479; Lanost-7,9(11)-dien-3-one-, 24,25-dihydroxy-(24S)-; (5R,10S,13R,14R,17R)-17-[(2R,5S)-5,6-dihydroxy-6-methyl-heptan-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one; Lanosta-7,9(11)-dien-3-one, 24,25-dihydroxy-, (24S)-; BDBM50356922; (5R,10S,13R,14R,17R)-17-[(2R,5S)-5,6-dihydroxy-6-methylheptan-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one | 456.7 | ||
| TCMBANKIN047347 | lucidone C | lucidone c | C24H36O5 | 404.54 | CC(=O)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)C)C)O |
| TCMBANKIN047723 | sinalbin | sinalbin ; 4-hydroxybenzyl-Glucosinolate | C14H19NO10S2 | 425.4 g/mol | C1=CC(=CC=C1CC(=NOS(=O)(=O)O)SC2C(C(C(C(O2)CO)O)O)O)O |
| TCMBANKIN048248 | lanosta-7,9(11),24-trien-3α,15α-diacetoxy-23-oxo-26-oic acid | lanosta-7,9(11),24-trien-3α,15α-diacetoxy-23-oxo-26-oicacid | C34H48O7 | 568.82 | |
| TCMBANKIN048520 | Lucidenic acid E2 | lucidenicacid e2 | 516.62 | ||
| TCMBANKIN048855 | Ganoderic acid AM1 | ganodericacid am1 | C30H42O7 | 514.65 | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)C)C |
| TCMBANKIN049047 | Ganodermadiol | 441 | |||
| TCMBANKIN049180 | lanosta-7,9(11),24-trien-3α-acetoxy-26-oic acid | lanosta-7,9(11),24-trien-3α-acetoxy-26-oicacid | C32H48O4 | 496.8 | |
| TCMBANKIN049442 | lucidenic acid M | lucidenicacid m | C27H42O6 | 462.62 | CC(CCC(=O)O)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)C)C)O |
| TCMBANKIN049843 | Lucidenic acid J | lucidenicacid j | 490.59 | ||
| TCMBANKIN057915 | FUM | U-1149; 110-17-8; 2-Butenedioic acid (E)-; 4-02-00-02202 (Beilstein Handbook Reference); FC 33; Kyselina fumarova; maleic acid; Fumarsaeure; 2-Butenedioic acid (2E)-; 240745_ALDRICH; 2-Butenedioic acid, (E)-; WLN: QV1U1VQ-T; Lichenic acid; LS-500; NSC2752; AIDS-008707; CCRIS 1039; 03761_FLUKA; Lichenic acid (VAN); Caswell No. 465E; W248800_ALDRICH; 2-butenedioic acid, (2E)-; (2E)-2-butenedioic acid; 6915-18-0; Boletic acid; EPA Pesticide Chemical Code 051201; FEMA No. 2488; HSDB 710; Fumaric acid (NF); NCIOpen2_003792; Tumaric acid; 1,2-Ethenedicarboxylic acid, trans-; CHEBI:18012; trans-Butenedioic acid; trans-1,2-Ethylenedicarboxylic acid; FC 33 (acid); fumaric acid; 2-Butenedioic acid; C00122; MALEATE; Allomalenic acid; 110-16-7; AIDS008707; trans-2-Butenedioic acid; AI3-24236; 623158-97-4; But-2-enedioic acid; D02308; NCI60_002239; 1,2-Ethylenedicarboxylic acid, (E); FEMA Number 2488; F8509_SIGMA; NCGC00091192-01; NSC-2752; trans-but-2-enedioic acid; Butenedioic acid, (E)-; Usaf ek-p-583; E-2-Butenedioic acid; BRN 0605763; EINECS 203-743-0; (2E)-but-2-enedioic acid; 2-Butenedioic acid (2E)- (9CI); (E)-2-butenedioic acid; nchembio.2007.47-comp1; Kyselina fumarova [Czech]; BUTENE-1,4-DIOIC ACID; Allomaleic acid; NCIOpen2_004870; Fumaric acid (8CI); CHEBI:22958; cis-butenedioic acid; 2-(E)-Butenedioic acid; MAE; fumaric acid; maiyenic acid; Maleic anhydride, mono(castor oil) ester; Maleic acid [NA2215] [Corrosive]; H2male; AIDS-025527; 2-Butenedioic acid (2Z)-, monocastor oil alkyl esters; InChI=1/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1; CCRIS 1115; 2-Butenedioic acid, (Z)-; 2-Butenedioic acid (Z)- (9CI); 44742-89-4; NCGC00090970-01; (Z)-butenedioic acid; 2-Butenedioic acid (Z)-; 2-butenedioic acid, (2Z)-; Kyselina maleinova [Czech]; (Z)-2-BUTENEDIOIC ACID; cis-but-2-enedioic acid; 2-Butenedioic acid (2Z)- (9CI); ST5213949; WLN: QV1U1VQ-C; Maleic acid (8CI); NSC 25940; 1,2-Ethylenedicarboxylic acid, (Z); 2-Butenedioic acid (2Z)-; (2Z)-but-2-enedioic acid; AI3-01002; 4-02-00-02199 (Beilstein Handbook Reference); 63189_FLUKA; CHEBI:18300; Malezid CM; NSC25940; NA2215; 10237-70-4; AIDS025527; cis-2-Butenedioic acid; EINECS 203-742-5; Maleinic acid; C01384; Malenic acid; HSDB 666; Scotchbond Multipurpose Etchant; BRN 0605762; M0375_SIAL; cis-1,2-Ethylenedicarboxylic acid; Maleic acid [NA2215] [Corrosive]; Butenedioic acid, (Z)-; 68307-91-5; but-2-enoic acid; methanoic acid; A802157; fumaricacid; 2-butenoic acid; formic acid | C4H4O4 | 116.07 | C(=CC(=O)O)C(=O)O |
| TCMBANKIN058038 | allylglucosinolate | SINIGRIN_qt | C10H16KNO9S2 | 397.5 g/mol | C=CCC(=NOS(=O)(=O)[O-])SC1C(C(C(C(O1)CO)O)O)O.[K+] |
| TCMBANKIN058046 | allyl isothiocyanate | Redskin; DTXSID3020047; Fats and Glyceridic oils, mustard; 3ZT10W4376; (T)ALLYL ISOTHIOCYANATE; Allyl isothiocyanate, PESTANAL(R), analytical standard, stabilized; Artificial oil of mustard; NSC 5572; Allyspol 75EC; Tox21_111165; ol eum sinapis volatile; Allylsenfoel; BBL027483; Allyl sevenolum; Senf oel; Tox21_202249; Mustard, brown (Brassica spp.); EINECS 232-358-0; EPA Pesticide Chemical Code 004901; DSSTox_CID_47; Allyl isothiocyanate, contains BHT as stabilizer, 95%; Oleum sinapis; 1058737-73-7; WLN: SCN2U1; Mustard oil, volatile; Mustard oil (VAN); AC1L1LIX; Isothiocyanic acid allyl ester; Essential oils, mustard; BN34FX42G3; Oil Of mustard; Allyl isothiocyanate, stabilized; Allyl isosulphocyanate; Mustardseed Oil; Tox21_302890; BP-12926; MFCD00004822; HMS3264D06; D02818; NSC760137; CHEMBL233248; FEMA No. 2034; 8007-40-7; Allyl isothiocyanate [USAN]; CTK1G9557; ZINC1687017; 50978-48-8; allylisothiocyanate; Brassica seed oil; 1957/6/7; Oil of mustard, expressed; ST51046777; CCG-213613; SBB060631; Allylisothiokyanat [Czech]; CCRIS 20; NCGC00091743-01; NCGC00256536-01; Allylsevenolum; Oils, brassica nigra; Allyl thioisocyanate; DSSTox_RID_75336; 3-isothiocyanatopropene; BDBM50203072; RL04154; NCGC00091743-02; 2-Propenyl isothiocyanate; UNII-BN34FX42G3; Caswell No. 027; Allyl mustard oil; CHEBI:73224; Allyl isothiocyanate, 97%; Allyl isothiocyanate (USP); Allyl isothiocyanate [USAN:USP]; I0185; prop-2-enisothiocyanate; Oil of mustard, artificial; Allyl isothiocyanate, stabilized [UN1545] [Poison]; 107231-30-1; Allyl isothiocyanate, >=95%, FCC; ALLYL ISOTHIOCYANATE; 58391-87-0; Allylsenevol; BRN 0773748; Isothiocyanate d'allyle; TR-019960; NSC-760137; 3-isothiocyanatopropene, 2-propenyl isothiocyanate, mustard oil, allyl isorhodanide, allyl mustard oil, synthetic mustard oil, allylsenevol, redskin, volatile oil of mustard; Volatile mustard oil; Isothiocyanate d'allyle [French]; 5832AE; Oils, brassica alba; J-512735; allyl isothiocyanate; ATC; AITC; Allylisothiokyanat; DB-022435; Senf oel [German]; FEMA Number 2034; Mustard, yellow (Brassica spp.); Allyl isothiocyanate, non-perfume grade; GTPL2420; LS-1387; 3-isothiocyanatoprop-1-ene; FT-0622027; allyl isorhodanide; AC1Q2ABE; UN1545; Mustard essential oils; AITK; Allyl isothiocyanate non-perfume grade; Potassium, (1-isothiocyanato-2-propenyl)-; NCI-C50464; NSC5572; C19317; Allyl isothiocyanate, stabilized [UN1545] [Poison]; Oils, essential, mustard; Senfoel; Y-9048; Allyl isosulfocyanate; F9995-1653; FT-0622004; 3-iso-Thiocyanatoprop-1-ene; Oleum sinapis volatile; Allyl isothiocyanate (natural); LS-3207; 3-isothiocyanato-prop-1-ene; Potassium allyl isothiocyanate; UNII-3ZT10W4376; 3-Isothiocyanato-1-propene; Oils, glyceridic, mustard; EINECS 200-309-2; AITC; allyl thiocarbonimide; InChI=1/C4H5NS/c1-2-3-5-4-6/h2H,1,3H; Carbospol; BB_SC-6433; Propene, 3-isothiocyanato-; allyl-iso-thiocyanate; Mustard oil, volatile, synthetic; Mustard Oil (Synthetic); D0BQ8Y; ZOJBYZNEUISWFT-UHFFFAOYSA-N; Artificial mustard oil; Isothiocyanic acid, allyl ester; MUSTARD OIL; I09-0185; 1-Propene, 3-isothiocyanato-; Oil of mustard BPC 1949; Allyl isothiocyanate, purum, >=98% (GC); MolPort-001-769-093; CAS-57-06-7; AC1Q2A9Q; AN-23573; Mustard seed oil; Isothiocyansaeureallylester; FEMA No. 2761; AI3-15283; ISOTHIOCYANIC ACID,ALLYL ESTER; NSC-5572; KB-47208; NCGC00259798-01; FEMA No. 2760; MCULE-3404572895; AB01563144_01; Allylsenfoel [German]; 50888-64-7; ALLYLISOTHIOCYANATE; Allyspol; Oils, mustard; Allyl isothiocyanate, inhibited; Pharmakon1600-01506103; Isothiocyanato-1-propene; Synthetic mustard oil; HSDB 617; Propenyl isothiocyanate; AKOS000119301; DSSTox_GSID_20047; Volatile oil of mustard; mustard oil; Redskin; DTXSID3020047; Fats and Glyceridic oils, mustard; 3ZT10W4376; (T)ALLYL ISOTHIOCYANATE; Allyl isothiocyanate, PESTANAL(R), analytical standard, stabilized; Artificial oil of mustard; NSC 5572; Allyspol 75EC; Tox21_111165; ol eum sinapis volatile; Allylsenfoel; BBL027483; Oil of mustard; Allyl sevenolum; Senf oel; Tox21_202249; Mustard, brown (Brassica spp.); EINECS 232-358-0; EPA Pesticide Chemical Code 004901; DSSTox_CID_47; Allyl isothiocyanate, contains BHT as stabilizer, 95%; Oleum sinapis; 1058737-73-7; WLN: SCN2U1; Mustard oil, volatile; Mustard oil (VAN); AC1L1LIX; Isothiocyanic acid allyl ester; Essential oils, mustard; BN34FX42G3; Oil Of mustard; Allyl isothiocyanate, stabilized; Allyl isosulphocyanate; Mustardseed Oil; Tox21_302890; BP-12926; MFCD00004822; HMS3264D06; D02818; NSC760137; CHEMBL233248; FEMA No. 2034; 8007-40-7; Allyl isothiocyanate [USAN]; CTK1G9557; ZINC1687017; 50978-48-8; Brassica seed oil; 1957/6/7; Oil of mustard, expressed; ST51046777; CCG-213613; SBB060631; Allylisothiokyanat [Czech]; CCRIS 20; NCGC00091743-01; NCGC00256536-01; Allylsevenolum; Oils, brassica nigra; Allyl thioisocyanate; DSSTox_RID_75336; 3-isothiocyanatopropene; BDBM50203072; RL04154; NCGC00091743-02; 2-Propenyl isothiocyanate; UNII-BN34FX42G3; Caswell No. 027; Allyl mustard oil; CHEBI:73224; Allyl isothiocyanate, 97%; ZINC01687017; Allyl isothiocyanate (USP); Allyl isothiocyanate [USAN:USP]; I0185; prop-2-enisothiocyanate; Oil of mustard, artificial; Allyl isothiocyanate, stabilized [UN1545] [Poison]; 107231-30-1; Allyl isothiocyanate, >=95%, FCC; ALLYL ISOTHIOCYANATE; 58391-87-0; Allylsenevol; BRN 0773748; Isothiocyanate d'allyle; TR-019960; NSC-760137; 3-isothiocyanatopropene, 2-propenyl isothiocyanate, mustard oil, allyl isorhodanide, allyl mustard oil, synthetic mustard oil, allylsenevol, redskin, volatile oil of mustard; Volatile mustard oil; Isothiocyanate d'allyle [French]; 5832AE; Oils, brassica alba; J-512735; Allylisothiokyanat; DB-022435; Senf oel [German]; FEMA Number 2034; Mustard, yellow (Brassica spp.); Allyl isothiocyanate, non-perfume grade; GTPL2420; LS-1387; 3-isothiocyanatoprop-1-ene; FT-0622027; Mustard oil; allyl isorhodanide; AC1Q2ABE; UN1545; Mustard essential oils; AITK; Allyl isothiocyanate non-perfume grade; Potassium, (1-isothiocyanato-2-propenyl)-; NCI-C50464; NSC5572; C19317; Allyl isothiocyanate, stabilized [UN1545] [Poison]; Oils, essential, mustard; Senfoel; Y-9048; Allyl isosulfocyanate; F9995-1653; FT-0622004; 3-iso-Thiocyanatoprop-1-ene; Oleum sinapis volatile; 377430_ALDRICH; Allyl isothiocyanate (natural); LS-3207; 3-isothiocyanato-prop-1-ene; Potassium allyl isothiocyanate; UNII-3ZT10W4376; 3-Isothiocyanato-1-propene; Oils, glyceridic, mustard; EINECS 200-309-2; AITC; allyl thiocarbonimide; InChI=1/C4H5NS/c1-2-3-5-4-6/h2H,1,3H; Carbospol; BB_SC-6433; Propene, 3-isothiocyanato-; 4-04-00-01081 (Beilstein Handbook Reference); allyl-iso-thiocyanate; Mustard oil, volatile, synthetic; Mustard Oil (Synthetic); D0BQ8Y; ZOJBYZNEUISWFT-UHFFFAOYSA-N; Artificial mustard oil; Isothiocyanic acid, allyl ester; MUSTARD OIL; I09-0185; 1-Propene, 3-isothiocyanato-; Oil of mustard BPC 1949; Allyl isothiocyanate, purum, >=98% (GC); W203408_ALDRICH; MolPort-001-769-093; CAS-57-06-7; AC1Q2A9Q; AN-23573; Mustard seed oil; Isothiocyansaeureallylester; FEMA No. 2761; AI3-15283; ISOTHIOCYANIC ACID,ALLYL ESTER; NSC-5572; KB-47208; NCGC00259798-01; FEMA No. 2760; MCULE-3404572895; 06019_FLUKA; AB01563144_01; Allylsenfoel [German]; 50888-64-7; ALLYLISOTHIOCYANATE; Allyspol; Oils, mustard; Allyl isothiocyanate, inhibited; Pharmakon1600-01506103; 57-06-7; Isothiocyanato-1-propene; Synthetic mustard oil; HSDB 617; 36682_RIEDEL; Propenyl isothiocyanate; AKOS000119301; DSSTox_GSID_20047; allylimino-thioxo-methane; Volatile oil of mustard | C4H5NS | 99.16 g/mol | C=CCN=C=S |
| TCMBANKIN058238 | sinalbine | sinalbin ; 4-hydroxybenzyl-Glucosinolate | C14H19NO10S2 | 425.4 g/mol | C1=CC(=CC=C1CC(=NOS(=O)(=O)O)SC2C(C(C(C(O2)CO)O)O)O)O |
| TCMBANKIN058334 | benzene acetaldehyde | benzeneacetaldehyde; HY1; c0210; alpha-Tolyaldehyde; 1-Oxo-2-phenylethane; 107395_ALDRICH; Acetaldehyde,phenyl- (8CI); ZINC00895323; Phenylacetic aldehyde; alpha-Tolualdehyde; NSC406309; alpha-Toluic aldehyde; 2-phenylacetaldehyde; NSC 406309; CHEBI:16424; FEMA No. 2974; 122-78-1; Phenylacetaldehyde solution; .alpha.-Tolualdehyde; W287407_ALDRICH; PHENYLACETALDEHYDE; W287415_ALDRICH; Benzylcarboxaldehyde; .alpha.-Toluic aldehyde; hyacinthin; Acetaldehyde,phenyl-; Phenylethanal; InChI=1/C8H8O/c9-7-6-8-4-2-1-3-5-8/h1-5,7H,6H; NCIOpen2_003602; AI3-02175; 77800_FLUKA; Phenylacetaldehyde (natural); 2-Phenylethanal; Oxophenylethane; Benzeneacetaldehyde; EINECS 204-574-5; C00601; phenylacetaldehyde; Hyacinthin | C8H8O | 120.15 g/mol | C1=CC=C(C=C1)CC=O |
| TCMBANKIN058336 | phenyl propionitrile | Phenethyl cyanide; 645-59-0; Phenylpropionitrile; ZINC01747831; 3-Phenylpropiononitrile; NSC16936; .beta.-Phenylpropionitrile; BRN 0636348; 4-09-00-01764 (Beilstein Handbook Reference); 3-Phenylpropionitrile; AI3-23733; BENZENEPROPANENITRILE; Hydrocinnamonitrile; Benzenepropionitrile; EINECS 211-447-8; Hydrocinnamique nitrile [French]; 171573_ALDRICH; NSC 16936; (2-Cyanoethyl)benzene; InChI=1/C9H9N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7H; 2-Phenylethyl cyanide; 3-Phenylpropanenitrile | C9H9N | 131.17 g/mol | C1=CC=C(C=C1)CCC#N |
| TCMBANKIN058350 | WLN: SCN2R | 253731_ALDRICH; 2-isothiocyanatoethylbenzene; NCI60_041942; Phenethyl isothiocyanate; ZERO/008133; Phenylethyl mustard oil; Phenylaethylsenfoel; EINECS 218-855-5; 4-12-00-02476 (Beilstein Handbook Reference); Phenylaethylsenfoel [German]; BRN 2084162; NSC 87868; 77972_FLUKA; .beta.-Phenylethyl isothiocyanate; 2-Phenylethyl isothiocyanate; Benzene, (2-isothiocyanatoethyl)-; .beta.-Phenethyl isothiocyanate; (2-isothiocyanatoethyl)benzene; Isothiocyanic acid, phenethyl ester; W401404_ALDRICH; beta-Phenylethyl isothiocyanate; NSC87868; CCRIS 3146; Phenethyl mustard oil; 2257-09-2; Phenylethyl isothiocyanate; ZINC02022074;phenethyl isothiocyanate;β-phenylethyl isothiocyanate;PEITC;beta-phenylethyl isothiocyanate;PEITC;beta-phenylethyl isothiocyanate | C9H9NS | 163.24 g/mol | C1=CC=C(C=C1)CCN=C=S |
| TCMBANKIN058354 | Urogran | NSC 118976; CHEBI:17484; benzyl isothiocyanate; NCIMech_000859; CHEBI:17484; KBio1_001724; (isothiocyanatomethyl)-benzene; MFCD00004819; UNII-871J6YOR8Q; KBioGR_001358; I0224; LS-7216; Benzene, (isothiocyanatomethyl)-; TR-033289; Isothiocyanatomethyl)benzene; Benzyl mustard oil; NCGC00094982-03; Spectrum_001820; KSC250O3D; AC1Q7EX9; KS-00000V2U; FT-0622167; 622-78-6; KBio2_007457; NSC-118976; ZINC1529592; HMS1921P18; KBio2_004889; Spectrum2_000852; DSSTox_RID_75407; Isothiocyanic Acid Benzyl Ester; CTK1F0731; NSC-758206; AB 2 (VAN); SCHEMBL44145; DB-022613; F0001-1663; DSSTox_CID_155; CCG-35868; Urogran; Pharmakon1600-01503006; KS-00001PQO; SPECTRUM1503006; Isothiocyanotaomethylbenzene; Benzene, isothiocyanatomethyl-; Spectrum5_001837; isothiocyanatomethyl-benzene; CJ-23924; Benzyl-isothiocyanate; DTXSID0020155; AB 2; phenylmethyl isothiocyanate; BRN 0386135; isothiocyanato-methyl-benzene; OTAVA-BB 1055640; AS04379; Benzylsenfoel [German]; AC1L1DH3; NSC118976; SBB002731; Tromalyt; alpha-Isothiocyanato-Toluene; WLN: SCN1R; Tromacaps; (Isothiocyanatomethyl)benzene; DSSTox_GSID_20155; ST50214559; 871J6YOR8Q; 1-(isothiocyanatomethyl)benzene; NSC758206; (Isothiocyanatomethyl)benzene, 9CI; Benzyl isothio cyanate; QTL1_000013; SBI-0052749.P002; CCRIS 3145; MCULE-5989558191; Toluene, alpha -isothiocyanato-; STK399787; 58019-05-9; NCIMech_000859; Isothiocyanic acid, benzyl ester; SDCCGMLS-0066697.P001; Spectrum4_001059; BITC, 17; TIMTEC-BB SBB002731; benzyl isothio cyanate; SR-05000002381; NCGC00094982-01; (Isothiocyanatomethyl)benzene #; a-isothiocyanatotoluene; CHEMBL55285; AI3-02736; EINECS 210-753-9; NCI60_000455; Benzyl isothiocyanate, 98%, FG; Tromocaps; AKOS000212138; NCGC00258743-01; Tromalyt active substance; KB-75435; PMITC cpd; ANW-34134; J-650076; MolPort-000-147-097; NCGC00094982-04; DivK1c_006780; alpha-isothiocyanatotoluene; Benzylisothiocyanate; RTR-033289; benzylisothiocyanate; NSC 118976; TL8004089; KBio2_002321; ZERO/008132; AC1Q7EYE; BBL013129; AKOS BBS-00004442; Spectrum3_000793; BDBM50240520; CAS-622-78-6; C03098; SPBio_000863; ACMC-209n1k; BB_SC-6549; KBio3_001746; I09-2433; BSPBio_002526; SR-05000002381-2; PubChem14549; isothiocyanatomethylbenzene; SpecPlus_000684; SC-13625; Benzyl isothiocyanate, analytical standard; Benzylsenfoel; Toluene, alpha-isothiocyanato-; Benzylsenfoel (german); AKOS JY2090023; LS11773; 4-12-00-02276 (Beilstein Handbook Reference); SR-05000002381-1; phenylmethanisothiocyanate; Toluene, .alpha.-isothiocyanato-; KBioSS_002323; Benzyl isothiocyanate, 98%; MDKCFLQDBWCQCV-UHFFFAOYSA-N; Tox21_201191; BITC; Benzyl isothiocyanate; NCGC00094982-02; AB00053249_03; FEMA 4428; BP-12924; KBio1_001724; KBio2_002321; (isothiocyanatomethyl)benzene; KBioGR_001358; Isothiocyanic acid, benzyl ester; ZERO/008132; Spectrum3_000793; Spectrum4_001059; SDCCGMLS-0066697.P001; C03098; SPECTRUM1503006; Benzene, (isothiocyanatomethyl)-; SPBio_000863; NCGC00094982-01; KBio3_001746; Spectrum5_001837; ZINC01529592; Benzyl mustard oil; Benzyl-isothiocyanate; AI3-02736; EINECS 210-753-9; BSPBio_002526; BRN 0386135; NCI60_000455; isothiocyanatomethylbenzene; SpecPlus_000684; Benzylsenfoel [German]; Spectrum_001820; NSC118976; Tromalyt; Toluene, alpha-isothiocyanato-; Benzylsenfoel; WLN: SCN1R; CCRIS 3145; Tromacaps; 4-12-00-02276 (Beilstein Handbook Reference); KBio2_007457; 622-78-6; Toluene, .alpha.-isothiocyanato-; KBioSS_002323; KBio2_004889; Spectrum2_000852; 252492_ALDRICH; Benzyl isothiocyanate; NCGC00094982-02; 13505_FLUKA; DivK1c_006780; AB 2 (VAN); Benzyl isothio cyanate; QTL1_000013; Benzylisothiocyanate; W510548_ALDRICH | C8H7NS | 149.21 g/mol | C1=CC=C(C=C1)CN=C=S |
| TCMBANKIN058356 | benzyl benzoate | BSPBio_003494; Benzylester kyseliny benzoove [Czech]; Scabitox; NCGC00094981-05; Ascabin; Benzyl benzoate, SAJ first grade, >=98.0%; Antiscabiosum; Peruscabina; MLS001336003; Spectrum2_000532; KBio1_000204; s4599; NCGC00258889-01; Vanzoate; Benzoic acid, phenylmethyl ester; MolPort-001-740-297; CTK0H4808; Benzyl benzenecarboxylate; Venzonate; NCGC00094981-01; NCGC00094981-02; Benzyl phenylformate; NINDS_000204; CAS-120-51-4; NCGC00094981-07; Scabiozon; D01138; CHEMBL1239; Ascabiol; Venzoate; Benylate (TN); Benzyl benzoate, natural, >=99%, FCC, FG; Benzyl benzoate, meets USP testing specifications; ANW-17509; CHEBI:41237; SESFRYSPDFLNCH-UHFFFAOYSA-N; NSC8081; Scobenol; Tox21_111372; Caswell No. 082; Benzyl benzoate, Pharmaceutical Secondary Standard; Certified Reference Material; BENZOIC ACID,BENZYL ESTER; Spasmodin; 1dzm; Pharmakon1600-01503002; HSDB 208; DSSTox_RID_78686; AB00052298_07; SMR000471875; Benzyl alcohol benzoic ester; Spectrum3_001757; SCHEMBL3038; C-24290; InChI=1/C14H12O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H; WLN: RVO1R; AC-17033; NSC 8081; B0064; Spectrum5_001128; KB-75431; AC1L1DH0; Novoscabin; SR-01000763773-2; Peruscabin; Tox21_201337; FEMA Number 2138; SPBio_000543; NCGC00094981-04; NSC-758204; DTXSID8029153; Acarobenzyl; Benzyl benzoate, >=99%; HMS2269D24; DB00676; DB-041563; BZM; KBioSS_001720; KS-00000UHX; Tox21_111372_1; Benzoic acid-benzyl ester (Benzyl benzoate); Q-200696; RL00855; Benzoesaeurebenzylester; Benzyl benzoate [USAN:JAN]; MLS001066412; Benzyl benzoate, SAJ special grade, >=99.0%; benzylbenzoate; Benzoate de benzyle; MFCD00003075; CCG-39578; Benzyl benzoate 99+ %; N863NB338G; Benzoesaurebenzylester; FEMA No. 2138; Scabide; Colebenz; Benzyl benzoate, ReagentPlus(R), >=99.0%; FT-0622708; SR-01000763773; Benzylbenzenecarboxylate; Benzyl ester; HMS500K06; HMS2092F20; AC1Q661C; Benzyl benzoate, for synthesis, 99.0%; NCGC00257502-01; EPA Pesticide Chemical Code 009501; ZINC1021; CC-24472; Benzylum benzoicum; Tox21_303418; MCULE-4369643785; BG01519431; Benzoic acid phenylmethyl ester; BDBM50134035; benzylbenzoat; DSSTox_GSID_29153; EC 204-402-9; Benzylets; I14-6951; benzoic acid benzyl; SBI-0051748.P002; 120-51-4; Scabanca; LS-2573; ST50406335; Benzyl benzoate, United States Pharmacopeia (USP) Reference Standard; DSSTox_CID_9153; KBio2_004288; Scabagen; ZB000222; KBio2_006856; D0G1VX; NSC-8081; Benzoic acid benzyl ester; FCH2703790; 4-09-00-00307 (Beilstein Handbook Reference); C12537; Spectrum4_000773; Benzyl benzoate, certified reference material, TraceCERT(R); A19449; Benzyl benzoate, tested according to Ph.Eur.; Benzoic acid, benzyl ester; Benzevan; AN-22825; Benzyl benzoate [USP:JAN]; KBio2_001720; Benzyl benzoate (natural); NCGC00094981-03; Benzylester kyseliny benzoove; DivK1c_000204; ACMC-1C8AP; SBB058609; SPECTRUM1503002; RTR-003391; HMS1921P16; IDI1_000204; KBio3_002714; KSC174Q0R; Benzoic acid benzyl ester; Benzoic acid phenylmethyl ester; UNII-N863NB338G; TR-003391; Spectrum_001240; BENZYL BENZOATE; Benzyl benzoate, 99% 250g; Benzylis benzoas; Benzyl benzoate (JP17/USP); Benzoic acid-benzyl ester 5000 ng/microl in n-Hexane; MLS001336004; AI3-00523; CHM0028580; EINECS 204-402-9; Phenylmethyl benzoate; HY-B0935; AKOS003495939; BENZOIC ACID PHENYLMETHYLESTER; NSC758204; Benylate; BENZYL BENZOATE BP98; Benzyl benzoat; Benzyl benzoate, analytical standard; KBioGR_001186; Benzyl benzoate, >=99%, FCC, FG; Benzyl benzoate, Vetec(TM) reagent grade, 98%; BRN 2049280;benzyl benzenecarboxylate;BZM | C14H12O2 | 212.24 g/mol | C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2 |
| TCMBANKIN058440 | 2-furancarboxaldehyde | 2-Furfuraldehyde; NCGC00091328-01; Furale; Caswell No. 466; CCRIS 1044; Nci-C56177; Fural; NSC8841; Furaldehydes [UN1199] [Poison]; LS-28; AI3-04466; EPA Pesticide Chemical Code 043301; 2-Furylcarboxaldehyde; 2-Furil-metanale [Italian]; NSC 8841; Furol; Furfural; 2-furfural; 2- Furfuraldehyde; furaldehyde; 48070_FLUKA; 2-Furylaldehyde xypropane; F1294-0048; 39276-09-0; Furfural (2-Furfurol, 2-Furaldehyde); Furfural, natural, >=98%, FCC, FG; Furfural, ACS reagent, 99%; FEMA No. 2968; CTK1B4104; Tox21_111114; Rcra waste number U125; 2-Furylcarboxaldehyde; KSC214C0J; 2-Furylaldehyde; 72277-EP2308870A2; ST50213385; EC 202-627-7; 2-furancarbaldehyde; QSPL 102; AKOS000118907; I14-0911; alpha-Furole; FURFURAL; AC1L1OL7; 2-Furil-metanale; BRN 0105755; furan-2-carboxaldehydl; Artificial ant oil; Fuf ural; BIDD:ER0698; F0073; QSPL 006; 2-Furancarbonal; 2-Furfural; WOOD VINEGAR; 2-Furaldehyde; Furfuraldehyde; 2-Furankarbaldehyd [Czech]; Furfurol; I14-22069; RL06103; 72277-EP2308867A2; CCRIS 1044; Fural; furfuraldehydl; Tox21_300170; EPA Pesticide Chemical Code 067206; KB-24259; Furaldehydes [UN1199] [Poison]; HYBBIBNJHNGZAN-UHFFFAOYSA-N; FEMA No. 2967; 2-Furil-metanale [Italian]; SC-18048; Furaldehydes; WLN: T5OJ BVH; ACMC-20978u; Furyl-methanal; 5-17-09-00292 (Beilstein Handbook Reference); Furfurylaldehyde; ZINC3861345; Furfurole; Furfurale [Italian]; UNII-N4G9GAT76C component HYBBIBNJHNGZAN-UHFFFAOYSA-N; Furaldehydes [UN1199] [Poison]; Tox21_202191; TRA0077688; 2-Furyl-methanal; CAS-98-01-1; Furfural (natural); 2-furaldehydl; EBD294; Caswell No. 904; 2-Furankarbaldehyd; 2-Furanaldehyde; FEMA No. 2489; BP-31002; Pyroligneous acids; CHEMBL189362; Artificial oil of ants; NCGC00253954-01; 2-Formylfuran; DSSTox_GSID_20647; DB-003668; Furol; NCGC00259740-01; LS-162370; 2-furan-carboxaldehyde; alpha-Furfuraldehyde; Caswell No. 466; NCGC00091328-04; Nci-C56177; Furfural, 99%; 2-FURANCARBOXALDEHYDE, ACS; LS-28; DTXSID1020647; AC1Q6PVV; AI3-04466; FEMA 2489; Fufural; furan-2-carbaldehyde; Ant Oil, artificial; Bran oil; Quakeral; Ant Oil; HSDB 542; Furane-2-carbaldehyde; STL283124; A845786; 2-Furylmethanal; ANW-13660; Furfurale; Wood Tar; RTC-069695; DSSTox_RID_75709; DJ1HGI319P; Furaldehyde; 2-Formylofuran; Furfural, for synthesis, 98.0%; UN1199; MCULE-5757882837; 2-Furancarboxaldehyde; 2-Furaldehyde, 8CI; NCGC00091328-02; Furfural, >=98%, FCC, FG; Qo furfural; furan-2-aldehyde; a-Furole; SBB004386; 2-furanal; 1998/1/1; Furale; NSC-8841; 72277-EP2277848A1; NSC8841; Furfural, SAJ first grade, >=99.0%; 2-Formyl furan; EPA Pesticide Chemical Code 043301; NSC 8841; U1199; UNII-DJ1HGI319P; EINECS 202-627-7; NCGC00091328-03; 2-Furaldehyde, 98% 250g; furan-2 carbaldehyde; Pyroligneous vinegar; CS-0015696; Furancarbonal; CHEBI:34768; a-furfuraldehyde; Furancarboxaldehyde; .alpha.-Furole; Pyromucic aldehyde; Furfuralu; Furole; RCRA waste no. U125; KS-00000WKJ; MolPort-000-871-210; EINECS 232-450-0; Furfural, analytical reference material; 2-Formylofuran [Polish]; DSSTox_CID_647; STR00358; InChI=1/C5H4O2/c6-4-5-2-1-3-7-5/h1-4; MFCD00003229; 2-furancarboxyaldehyde; AM81812; Pyroligneous acid extract; C14279; Furan-2-carboxaldehyde; EINECS 202-627-7; furan-2-carbaldehyde; WLN: T5OJ BVH; 2-Furylaldehyde; Ant Oil, artificial; Furancarbonal; Bran oil; Furyl-methanal; 5-17-09-00292 (Beilstein Handbook Reference); Furfurylaldehyde; HSDB 542; Quakeral; Furfurole; Furfurale [Italian]; Furfurale; .alpha.-Furole; FURFURAL; Pyromucic aldehyde; ZINC03861345; 2-Furyl-methanal; 2-Furil-metanale; BRN 0105755; Furole; Furfural (natural); RCRA waste no. U125; Furaldehyde; Artificial ant oil; 2-Furaldehyde, purified; W248908_ALDRICH; 2-Formylofuran [Polish]; UN1199; 2-Furanaldehyde; FEMA No. 2489; 2-Furancarboxaldehyde; 185914_ALDRICH; 2-Furancarbonal; 2-Furfural; InChI=1/C5H4O2/c6-4-5-2-1-3-7-5/h1-4; Artificial oil of ants; 2-Furaldehyde; RCRA waste number U125; 319910_SIAL; 2-Formylfuran; Furfuraldehyde; C14279; Furan-2-carboxaldehyde; Furfurol; SBB004386; 98-01-1; W248924_ALDRICH; 2-Furankarbaldehyd [Czech]; 2-Furylaldehyde xypropane; F1294-0048; 39276-09-0; Furfural (2-Furfurol, 2-Furaldehyde); Furfural, natural, >=98%, FCC, FG; Furfural, ACS reagent, 99%; FEMA No. 2968; CTK1B4104; Tox21_111114; Rcra waste number U125; 2-Furylcarboxaldehyde; KSC214C0J; 2-Furylaldehyde; 72277-EP2308870A2; ST50213385; EC 202-627-7; 2-furancarbaldehyde; QSPL 102; AKOS000118907; I14-0911; alpha-Furole; FURFURAL; AC1L1OL7; 2-Furil-metanale; BRN 0105755; furan-2-carboxaldehydl; Artificial ant oil; Fuf ural; BIDD:ER0698; F0073; QSPL 006; 2-Furancarbonal; 2-Furfural; WOOD VINEGAR; 2-Furaldehyde; Furfuraldehyde; 2-Furankarbaldehyd [Czech]; Furfurol; I14-22069; RL06103; 72277-EP2308867A2; CCRIS 1044; Fural; furfuraldehydl; Tox21_300170; EPA Pesticide Chemical Code 067206; KB-24259; Furaldehydes [UN1199] [Poison]; HYBBIBNJHNGZAN-UHFFFAOYSA-N; FEMA No. 2967; 2-Furil-metanale [Italian]; SC-18048; Furaldehydes; WLN: T5OJ BVH; ACMC-20978u; Furyl-methanal; 5-17-09-00292 (Beilstein Handbook Reference); Furfurylaldehyde; ZINC3861345; Furfurole; Furfurale [Italian]; UNII-N4G9GAT76C component HYBBIBNJHNGZAN-UHFFFAOYSA-N; Furaldehydes [UN1199] [Poison]; Tox21_202191; TRA0077688; 2-Furyl-methanal; CAS-98-01-1; Furfural (natural); 2-furaldehydl; EBD294; Caswell No. 904; 2-Furankarbaldehyd; 2-Furanaldehyde; FEMA No. 2489; BP-31002; Pyroligneous acids; CHEMBL189362; Artificial oil of ants; NCGC00253954-01; 2-Formylfuran; DSSTox_GSID_20647; DB-003668; Furol; NCGC00259740-01; LS-162370; 2-furan-carboxaldehyde; alpha-Furfuraldehyde; Caswell No. 466; NCGC00091328-04; Nci-C56177; Furfural, 99%; 2-FURANCARBOXALDEHYDE, ACS; LS-28; DTXSID1020647; AC1Q6PVV; AI3-04466; FEMA 2489; Fufural; furan-2-carbaldehyde; Ant Oil, artificial; Bran oil; Quakeral; Ant Oil; HSDB 542; Furane-2-carbaldehyde; STL283124; A845786; 2-Furylmethanal; ANW-13660; Furfurale; Wood Tar; RTC-069695; DSSTox_RID_75709; DJ1HGI319P; Furaldehyde; 2-Formylofuran; Furfural, for synthesis, 98.0%; UN1199; MCULE-5757882837; 2-Furancarboxaldehyde; 2-Furaldehyde, 8CI; NCGC00091328-02; Furfural, >=98%, FCC, FG; Qo furfural; furan-2-aldehyde; a-Furole; SBB004386; 2-furanal; 1998/1/1; Furale; NSC-8841; 72277-EP2277848A1; NSC8841; Furfural, SAJ first grade, >=99.0%; 2-Formyl furan; EPA Pesticide Chemical Code 043301; NSC 8841; U1199; UNII-DJ1HGI319P; EINECS 202-627-7; NCGC00091328-03; 2-Furaldehyde, 98% 250g; furan-2 carbaldehyde; Pyroligneous vinegar; CS-0015696; Furancarbonal; CHEBI:34768; a-furfuraldehyde; Furancarboxaldehyde; .alpha.-Furole; Pyromucic aldehyde; Furfuralu; Furole; RCRA waste no. U125; KS-00000WKJ; MolPort-000-871-210; EINECS 232-450-0; Furfural, analytical reference material; 2-Formylofuran [Polish]; DSSTox_CID_647; STR00358; InChI=1/C5H4O2/c6-4-5-2-1-3-7-5/h1-4; MFCD00003229; 2-furancarboxyaldehyde; AM81812; Pyroligneous acid extract; C14279; Furan-2-carboxaldehyde | C5H4O2 | 96.08 g/mol | C1=COC(=C1)C=O |
| TCMBANKIN058450 | ADO | nchembio.2007.56-comp13; CHEBI:16335; Bio1_000437; 9-beta-D-Ribofuranosyl-9H-purin-6-amine; AIDS-001224; 9beta-D-Ribofuranosyladenine; BSPBio_001796; beta-Adenosine; (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-methylol-tetrahydrofuran-3,4-diol; beta-D-Ribofuranoside, adenine-9; D00045; 46969-16-8; SDCCGMLS-0003108.P003; 4-Aminopyrazolo[3,4-d]pyrimidine ribonucleoside; (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol; 6-Amino-9-.beta.-ribofuranosyl-9H-purine; NSC 7652; Bio1_001415; Adenosine (JAN/USP); Spectrum2_001257; Spectrum3_000288; Adenosine, homopolymer; ADN; Caswell No. 010B; Adenocard; C00212; SR 96225; Adenocard (TN); EINECS 200-389-9; KBio3_001296; 9H-Purin-6-amine, 9beta-D-ribofuranosyl-; Polyadenosine; beta-D-Ribofuranose, 1-(6-amino-9H-purin-9-yl)-1-deoxy-; (2R,3R,4S,5R)-2-(6-amino-9-purinyl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol; MLS000069638; AI3-52413; 9-beta-D-Ribofuranosidoadenine; A9251_SIGMA; Adenoscan (TN); Bio1_000926; ZINC02169830; CCRIS 2557; NCGC00023673-05; Ade-Rib; nchembio706-5; 30143-02-3; 6-Amino-9-beta-D-ribofuranosyl-9H-purine; Adenosin [German]; NSC 627048; SMR000058216; 9-beta-D-Ribofuranosyladenine; SPBio_001194; beta-D-Adenosine; Adenosine [USAN:BAN]; Polyriboadenosine; (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol; AIDS001224; 6-Amino-9beta-D-ribofuranosyl-9H-purine; ST009496; Adenoscan; A4036_SIGMA; SPECTRUM1500107; 46946-45-6;SCHEMBL170902; adenosine ; AKOS015960342; AC-5504; BC200893; Adenosine;adenosine;adeninenucleoside | C10H13N5O4 | 267.24 g/mol | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N |
| TCMBANKIN058885 | tsugaricacid a | 24-trien-21-oic acid | C32H50O4 | 498.7 g/mol | CC(=CCCC(C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)C(=O)O)C |
| TCMBANKIN059041 | 5-(3-buten-1-ynyl)-2,2'-bithienyl-5’-methyl-acetate | 5-(3-buten-1-ynyl)-2,2'-bithienyl-5'-methylacetate | C15H12O2S2 | CC(=O)OCC1=CC=C(S1)C2=CC=C(S2)C#CC=C | |
| TCMBANKIN059147 | ergosterin | ergosterol;24-Methylcholesta-5,7,22-trien-3beta-ol; 24alpha-Methyl-22E-dehydrocholestero; (3beta,22E)-Ergosta-5,7,22-trien-3-ol; (7S,9AR,11AR)-1-[(2R,3E,5R)-5,6-DIMETHYLHEPT-3-EN-2-YL]-9A,11A-DIMETHYL-1H,2H,3H,3AH,6H,7H,8H,9H,9BH,10H,11H-CYCLOPENTA[A]PHENANTHREN-7-OL; 45480_FLUKA; (24R)-Ergosta-5,7,22-trien-3b-ol; MEGxm0_000450; Ergosterin; 24R-Methylcholesta-5,7,22E-trien-3b-ol; 57-87-4; Ergosterol; ergosta-5,7,22E-trien-3beta-ol; (3beta)-Ergosta-5,7,22-trien-3-ol; C01694; 5,7,22-Ergostatrien-3beta-ol; AIDS064232; E6510_SIGMA; Provitamin D2; (22E)-Ergosta-5,7,22-trien-3.beta.-ol; A831651; ergosta-5,7,22-trienol; ergosta-5,7,22-trien-3 beta-ol; 24R-Methylcholesta-5,7,22E-trien-3beta-ol; ACon0_000429; ERG; ST073383; (3S,10R,13R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol; 24-Methylcholesta-5,7,22-trien-3b-ol; ACon1_000637; (3beta,2E)-Ergosta-5,7,22-trien-3-ol; Provitamine D2; AIDS-064232; 24a-Methyl-22E-dehydrocholesterol; ergosta-5,7,22-trien-3-ol; 47130U_SUPELCO; LMST01030093; (22E)-ergosta-5,7,22-trien-3beta-ol; ZINC04084618; (3S,9S,10R,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol; 3beta-Hydroxy-5,7,22-ergostatriene; CHEBI:16933; (3S,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(E,1R,4R)-1,4,5-trimethylhex-2-enyl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol; (22E,24S)-24-methylcholesta-5,7,22-trien-3beta-ol | C28H44O | 396.6 g/mol | CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C |
| TCMBANKIN059149 | Ergosterol peroxide | 2061-64-5; NSC31324; Ergosterol peroxide; 5.alpha.,8.alpha.-Ergosta-6,22-dien-3.beta.-ol, 5,8-epidioxy-; ERGOSTEROL-5,8-PEROXIDE; Ergosterol 5.alpha.,8.alpha.-epidioxide; Ergosta-6,22-dien-3-ol, 5,8-epidioxy-, (3.beta.,5.alpha.,8.alpha.,22E)-; Ergosterol endoperoxide; (3β,5α,8α,22E,24R)-5,8-Epidioxyergosta-6,22-dien-3-ol; 5,8-epidioxyergosta-6,22-dien-3-ol; Peroxyergosterol; ergosterol peroxide; 2061-64-5; ergosterolperoxide; dimethyl-[(E,1R,4R)-1,4,5-trimethylhex-2-enyl][?]ol; (3.beta.,5.alpha.,8.alpha.,22E)-5,8-Epidioxyergosta-6,22-dien-3-ol | C28H44O3 | 428.6 g/mol | CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C24C=CC5(C3(CCC(C5)O)C)OO4)C |
| TCMBANKIN059152 | campesterol-D-goycoside | 24-methylcholest-5-enyl-3belta-o-glucopyranoside | C34H58O6 | 562.92 | CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C |
| TCMBANKIN059264 | ganoine | ganoine i; ganonine | C11H17NO2 | 195.26 g/mol | CC(C)CCN1C(=CC=C1C=O)CO |
| TCMBANKIN059270 | 5,6-dihydropiperlonguminine | 4,5-dihydropiperlonguminine;dihydropiperlonguminine | C16H21NO3 | 275.34 g/mol | CC(C)CNC(=O)C=CCCC1=CC2=C(C=C1)OCO2 |
| TCMBANKIN059307 | ganosporeric acid a(1) | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(C(=O)C(=O)C3=C2C(=O)CC4C3(CCC(=O)C4(C)C)C)C)C | |||
| TCMBANKIN059308 | 12-Deacetylganoderic acid H | 12-deacetylganoderic acid h;Ganoderic acid C6 | C30H42O8 | 530.72g/mol | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(C(C(=O)C3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)O)C)C |
| TCMBANKIN059309 | ganoderic acid G | ganode-8-en-ricacid g | C30H44O8 | 532.67 | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(C(C(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)O)C)C |
| TCMBANKIN059310 | ganodericacid c1 | ganodericacid c; ganoderic acid D; ganode-8-en-ricacid c1 | C30H42O7 | 514.6 g/mol | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C |
| TCMBANKIN059311 | ganoderic acid B | ganode-8-en-ricacid b; ganoderic acid b | C30H44O7 | 516.67 | CC(CC(=O)CC(C)C(=O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)C)C |
| TCMBANKIN059312 | ganoderic acid AP | ganoderic acid a; ganoderic acid A; ganode-8-en-ricacid a | C30H44O7 | 516.67 | CC(CC(=O)CC(C)C(=O)O)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C)O |
| TCMBANKIN059321 | Ganoderic acid theta | ganodericacid θ | C30H42O8 | 530.65 | CC(CC(C=C(C)C(=O)O)O)C1CC(=O)C2(C1(C(C(=O)C3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)O)C)C |
| TCMBANKIN059322 | Ganoderic acid zeta | ganodericacid ζ;ganoderic acid Z;Ganoderic acid XL;ganodericacidz | C30H42O7 | 514.6 g/mol;456.7 | CC(CC(C=C(C)C(=O)O)O)C1CC(=O)C2(C1(CC(=O)C3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)C)C |
| TCMBANKIN059323 | Ganoderic acid delta | ganodericacid δ | C30H44O7 | 516.7 g/mol | CC(CC(C=C(C)C(=O)O)O)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C)O |
| TCMBANKIN059345 | ganoderic acid TQ | ganodericacid t-q | C32H46O5 | 510.7 g/mol | CC(CCC=C(C)C(=O)O)C1CC(C2(C1(CC=C3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C)OC(=O)C |
| TCMBANKIN059357 | ganodermenonol | (5R,10S,13R,14R,17R)-17-[(E,2R)-7-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one;(5R,10S,13R,14R,17R)-17-[(E,1R)-6-hydroxy-1,5-dimethylhex-4-enyl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one; (5R,10S,13R,14R,17R)-17-[(E,2R)-7-hydroxy-6-methyl-hept-5-en-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one; | C30H46O2 | 438.68 | CC(CCC=C(C)CO)C1CCC2(C1(CC=C3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C |
| TCMBANKIN059735 | Biosol | C10H14O | 150.22 g/mol | CC1=C(C=CC(=C1)O)C(C)C | |
| TCMBANKIN059837 | methyl thymyl ether | C11H16O | 164.24 g/mol | CC1=CC(=C(C=C1)C(C)C)OC | |
| TCMBANKIN059912 | p-cresol | C7H8O | 108.14 g/mol | CC1=CC=C(C=C1)O | |
| TCMBANKIN059921 | o- Cymene | C10H14 | 134.22 g/mol | CC1=CC=CC=C1C(C)C | |
| TCMBANKIN060713 | Methyl jasmonate | C13H20O3 | 224.3 g/mol | CCC=CCC1C(CCC1=O)CC(=O)OC | |
| TCMBANKIN060868 | trans-2,4-decadienal | C10H16O | 152.23 g/mol | CCCCCC=CC=CC=O | |
| TCMBANKIN060879 | Linolic acid | C18H32O2 | 280.4 g/mol | CCCCCC=CCC=CCCCCCCCC(=O)O | |
| TCMBANKIN060958 | oleic acid;cis-oleic acid;oleinic acid | C18H34O2 | 282.46 | CCCCCCCCC=CCCCCCCCC(=O)O | |
| TCMBANKIN060964 | butyl 9-octadecenoate or 9-18:1 | C22H42O2 | 338.6 g/mol | CCCCCCCCC=CCCCCCCCC(=O)OCCCC | |
| TCMBANKIN060969 | Erucic acid | C22H42O2 | 338.57 | CCCCCCCCC=CCCCCCCCCCCCC(=O)O | |
| TCMBANKIN061091 | stearic acid | CH3(CH2)16COOH | 284.5 g/mol | CCCCCCCCCCCCCCCCCC(=O)O | |
| TCMBANKIN061105 | Eicosanoic acid | C20H40O2 | 312.53 g/mol | CCCCCCCCCCCCCCCCCCCC(=O)O | |
| TCMBANKIN061118 | behenic acid | C22H44O2 | 340.6 g/mol | CCCCCCCCCCCCCCCCCCCCCC(=O)O | |
| TCMBANKIN061201 | Butyl mustard oil | C5H9NS | 115.2 g/mol | CCCCN=C=S | |
| TCMBANKIN061257 | catalase | C9H10O3 | 166.17 g/mol | CCOC(=O)C1=CC=C(C=C1)O | |
| TCMBANKIN061365 | Sinoacutine | (-)-salutaridine; C05179; sinoacutine; (-)-Sinoacutine; 5,6,8,14-Tetradehydro-4-hydroxy-3,6-dimethoxy-17-methyl-morphinan-7-one; 4-Hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7-one; SCHEMBL563455; 1369-69-3; (+-)-SALUTARIDINE; 7X10PRH74D; Salutaridine; 1936-18-1; 1005309-77-2; BDBM50378615; Morphinan-7-one, 5,6,8,14-tetradehydro-4-hydroxy-3,6-dimethoxy-17-methyl-; GVTRUVGBZQJVTF-YJYMSZOUSA-N; (+)-salutaridine; CHEBI:17225; 716342-86-8; CHEMBL404097; HSDB 8325; Sinoacutin; UNII-7X10PRH74D; 4-hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7-one; 17039-45-1; Floripavine | C19H21NO4 | 327.37 | CN1CCC23C=C(C(=O)C=C2C1CC4=C3C(=C(C=C4)OC)O)OC |
| TCMBANKIN061508 | methyleugenol | 29T9VA6R7M; 1,4-Eugenol methyl ether; DSSTox_RID_77851; FEMA No. 2475; MLS001333206; ST24043178; ST50330558; Benzene,2-dimethoxy-4-(2-propenyl)-; FR-0577; NCGC00254085-01; CTK3J0502; HMS2269M09; HSDB 4504; 3,4-Dimethoxyallyl benzene; NSC-8900; Tox21_202347; ENT 21040; SBB007916; NCGC00091474-04; C10454; o-Methyl eugenol ether; NSC209528; ACMC-209rk6; MolPort-000-154-691; Eugenyl methyl ether; AS-14807; Tox21_300071; STK801819; Benzene, 4-allyl-1,2-dimethoxy-; CAS-93-15-2; NSC 209528; AK162493; FEMA Number 2475; Methyl eugenol, analytical standard; NSC8900; TRA0076734; Methyleugenol; LS-29885; AC1L1O2J; BRN 1911284; MLS001065600; 2-Methoxy-4-propenylphenol methyl ether; 3-06-00-04995 (Beilstein Handbook Reference); cis-Methyl isoeugenol; W247502_ALDRICH; RTR-029187; 1-(3, 4-Dimethoxyphenyl)-2-propene; DSSTox_CID_5607; 10005-561a; methyl eugenol; 3-(3,4-dimethoxyphenyl)-1-propene; O-Methyl eugenol; NSC-209528; CHEMBL108861; 4-Allylveratrol; SMR000112378; Methyl eugenol; W-100251; 1-(3,4-Dimethoxyphenyl)-2-propene; BG00601894; 1,2-dimethoxy-4-prop-2-enylbenzene; ZINC388674; 4-Allylveratrole; BB_NC-0711; 4-06-00-06337 (Beilstein Handbook Reference); CCRIS 746; Allyl-1,2-dimethoxybenzene; Allylveratrol; ZINC00388674; Methy l eugenyl ether; Dimethoxy-4-(2-propenyl)benzene; DSSTox_GSID_25607; EC 202-223-0; 1, 2-Dimethoxy-4-(2-propenyl)benzene; Methyl eugenol ether; M664; Benzene, 1,2-dimethoxy-4-propenyl-, (Z)-; BDBM50379791; 46110_FLUKA; Caswell No. 579AB; 1,2-Dimethoxy-4-allyl benzene; AIDS-224738; FT-0626371; METHYLEUGENOL; 1,3,4-Eugenol methyl ether; DTXSID5025607; AIDS224738; Eugenol methyl ether; Methyleugenol (4-Allyl-1,2-dimethoxybenzene); WLN: 1U2R CO1 DO1; Benzene, 1,2-dimethoxy-4-(2-propenyl)-; C11H14O2; NCGC00259896-01; 6380-24-1; KS-000001JX; 93-15-2; MFCD00008652; BBL027720; 284424_ALDRICH; ZYEMGPIYFIJGTP-UHFFFAOYSA-N; 1,2-dimethoxy-4-(prop-2-en-1-yl)benzene; Benzene, 4-(2-propenyl)-1,2-dimethoxy; BRN 1910871; TR-029187; Methyl Eugenol Natural; DB-002806; 1,2-dimethoxy-4-prop-2-enyl-benzene; 4-Allyl-1,2-dimethoxybenzene; EINECS 202-223-0; KB-177539; 1,2-Dimethoxy-4-allylbenzene; SCHEMBL10108224; AN-24255; LS-15; Veratrole methyl ether; AC1Q46TK; NCGC00091474-01; AC1Q4FDV; BBV-39688198; 1,2-Dimethoxy-4-(2-propen-1-yl)benzene; NCGC00091474-02; 4-Allyl-1,2-dimethoxybenzene, 99%; 3,4-Dimethoxyallylbenzene; MLS001333205; BB_NC-00711; ANW-39988; 1,2-Dimethoxy-4-(2-propenyl)benzene; methyl eugenol ; 4-Allyl-1,2-dimethyoxybenzene; EPA Pesticide Chemical Code 203900; AKOS015838877; FEMA 2475; cis-4-Propenyl veratrole; Methyl eugenol, >=98%, FCC; CHEBI:4918; 4-allyl-1,2-dimethoxy-benzene; AX8129901; Eugenol methyl; UNII-29T9VA6R7M; Benzene, 1,2-dimethoxy-4-(2-propen-1-yl)-; Eugenol methylether; SCHEMBL113794; NCGC00091474-03; AI3-21040; 1-Allyl-3,4-dimethoxybenzene; 4-Allyl-1, 2-dimethoxybenzene; Methyl eugenyl ether; O-Methyleugenol;eugenyl methylether;Benzene, 1,2-dimethoxy-4-(2-propenyl)-;eugenol methyl ether;1,2-dimethoxy-4-(2-propenyl)benzene;Methyleugenol-;SCHEMBL219169;1,2-Dimethoxy-4-(2-propenyl)benzene | C11H14O2 | 178.23g/mol | COC1=C(C=C(C=C1)CC=C)OC |
| TCMBANKIN061588 | 4-hydroxy-3-methoxybenzaldehyde | 3-methoxy-4-hydroxybenzaldehyd;vanillin | C8H8O3 | 152.15 g/mol | COC1=C(C=CC(=C1)C=O)O |
| TCMBANKIN061749 | 6'-sinapoylspinosin | 6' -Sinapoylspinosin; [(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(4-hydroxyphenyl)-7-methoxy-4-oxo-5,6-dihydrochromen-6-yl]oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate; AC1NT0EY | C39H44O19 | 800.83 | COC1=CC(=CC(=C1O)OC)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C5C(=C4O)C(=O)C=C(O5)C6=CC=C(C=C6)O)OC)CO)O)O)O)O)O |
| TCMBANKIN061942 | 3-methylthiopropyl isothiocyanate | 3-Methylthiopropyl isothiocyanate, >=98%, FG; 1-Isothiocyanato-3-(methylthio)-Propane; CAS-505-79-3; 1-Isothiocyanato-3-(methylthio)propane; CJ-30437; KB-27647; I09-1142; M2027; 1-isothiocyanato-3-methylsulfanyl-propane; 3-(methylthio)propylisothiocyanate; CHEMBL3186484; AC1L1WY7; 3-Methylthiopropyl isothiocyanate; Propane,1-isothiocyanato-3-(methylthio)-; FEMA 3312; ACMC-209knx; A828183; UNII-YTT13BN94Z; CTK4J2815; YTT13BN94Z; 3-Methyl thiopropyl isothiocyanate; FEMA No. 3312; SBB066566; TRA-0184764; 1-Isothiocyanato-3-(methylsulfanyl)propane; W-105949; PROPANE, 1-ISOTHIOCYANATO-3-(METHYLTHIO)-; DSSTox_GSID_47132; Isothiocyanic acid, 3-(methylthio)propyl ester; ZINC1850039; 3-(Methylthio)propyl isothiocyanate; LS-2964; 1-Isothiocyanato-3-(methylsulfanyl)propane #; 3-methylthiopropanisothiocyanate; 3-(methylthio) propyl isothiocyanate; BDBM50104731; DSSTox_CID_27132; BP-12929; AN-45414; VZ35159; Iberverin; 1-isothiocyanato-3-methylsulfanylpropane; TC-119796; NCGC00256650-01; LDKSCZJUIURGMW-UHFFFAOYSA-N; 3-Methylmercaptopropyl isothiocyanate; Isothiocyanic Acid 3-(Methylthio)propyl Ester; Ibervirin; AKOS000120740; U302; radish isothiocyanate; DTXSID3047132 | C5H9NS2 | 147.3 g/mol | CSCCCN=C=S |
植物对应的疾病
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植物对应的靶点
| 靶点ID | 基因名 | 基因别名 | 描述 | 染色体位置 | Map_Location | 基因类型 |
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