TCMBANKIN000001 |
saikosaponin a |
20736-09-8; Saikosaponin A; beta-D-Galactopyranoside, (3beta,4alpha,16beta)-13,28-epoxy-16,23-dihydroxyolean-11-en-3-yl-6-deoxy-3-O-beta-D-glucopyranosyl-; saikosaponin-a; AIDS-211406; AIDS211406; C08975 |
C42H68O13 |
780.98 |
CC1C(C(C(C(O1)OC2CCC3(C(C2(C)CO)CCC4(C3C=CC56C4(CC(C7(C5CC(CC7)(C)C)CO6)O)C)C)C)O)OC8C(C(C(C(O8)CO)O)O)O)O |
TCMBANKIN007718 |
2,6-Dimethylpiazine |
2,6-Dimethylpyrazine (natural); 2,6-DIMETHYLPYRAZINE; W327301_ALDRICH; FEMA No. 3273; 108-50-9; InChI=1/C6H8N2/c1-5-3-7-4-6(2)8-5/h3-4H,1-2H; 2,6-Dimethylparadiazine; EINECS 203-589-4; 2,6-Dimethyl-1,4-diazine; D181803_ALDRICH; CCRIS 2930; Pyrazine, 2,6-dimethyl-; ZINC00404377; 3,5-Dimethylpyrazine |
C6H8N2 |
108.14 |
CC1=CN=CC(=N1)C |
TCMBANKIN007867 |
sacranoside a |
|
C20H32O10 |
432.5 g/mol |
CC1(C2CC=C(C1C2)OC3C(C(C(C(O3)COC4C(C(C(CO4)O)O)O)O)O)O)C |
TCMBANKIN008344 |
n- eleven(carbon)alkyl |
|
|
|
|
TCMBANKIN008438 |
Saikosaponin K |
saikosaponin k |
C54H88O22 |
1089.3 g/mol |
CC1(CCC2(CCC3(C(=C2C1)C=CC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)C)C)C)CO)C |
TCMBANKIN009531 |
Seven(alkyl)carbon |
|
|
|
|
TCMBANKIN010965 |
myrtanol |
AC1L38DM; MFCD00066424; [(1R,4R,5R)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]methanol; ((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methanol; (-)-cis-Myrtanol; (1S,2R)-10-Pinanol; LDWAIHWGMRVEFR-CIUDSAMLSA-N; SCHEMBL3653711; (1beta,5beta)-6,6-Dimethylbicyclo[3.1.1]heptane-2alpha-methanol; cis-Myrtanol; ZINC2242637; [(1S,2R,5S)-6,6-DIMETHYLBICYCLO[3.1.1]HEPTAN-2-YL]METHANOL; ((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]-heptan-2-yl)methanol; (1S,2R)-6,6-Dimethylbicyclo[3.1.1]heptane-2-methanol; (-)-cis-Myrtanol, analytical standard; AKOS006237611; Bicyclo[3.1.1]heptane-2-methanol, 6,6-dimethyl-, (1S,2R,5S)-; AC1Q2CC5; 51152-12-6 |
C10H18O |
154.25 g/mol |
CC1(C2CCC(C1C2)CO)C |
TCMBANKIN012868 |
Saikogenin F |
saikogenin f |
C30H48O4 |
472.7 g/mol |
CC1(CCC23COC4(C2C1)C=CC5C6(CCC(C(C6CCC5(C4(CC3O)C)C)(C)CO)O)C)C |
TCMBANKIN016445 |
5,7,4'-trihydroxy-6-(3,3-dimethylallyloxiranyl-methyl)isoflavone |
|
C23H22O6 |
394.4 g/mol |
CC(=CCC(C1CO1)C2=C(C3=C(C=C2O)OC=C(C3=O)C4=CC=C(C=C4)O)O)C |
TCMBANKIN018745 |
Norbornene |
|
C7H10 |
94.15 g/mol |
C1CC2CC1C=C2 |
TCMBANKIN018792 |
Isorhmnetin |
|
|
|
|
TCMBANKIN019010 |
Saikogenin G |
saikogenin g |
C30H48O4 |
472.7 |
CC1(CCC23COC4(C2C1)C=CC5C6(CCC(C(C6CCC5(C4(CC3O)C)C)(C)CO)O)C)C |
TCMBANKIN020935 |
13(18)- diene-3-O-β-D- glucopyranosyl-1 → 6- [β-D- glucopyranosyl-1 → 2]-β-D- glucopyranoside |
|
|
|
|
TCMBANKIN022960 |
2-methylcyclopentanone |
(2S)-2-methylcyclopentan-1-one; AJ-33209; 2-methyl-cyclopentanone; 2beta-Methylcyclopentanone; AC1OE5RY; (s)-2-methylcyclopentanone; ZINC2039888 |
C6H10O |
98.14 g/mol |
CC1CCCC1=O |
TCMBANKIN023890 |
δ- Cubeb oleyl |
|
|
|
|
TCMBANKIN024021 |
3β,16β,23-trihydroxy-13,28-epoxyolean-11-en-3β-yl-[β-d-glucopyranosyl-(1→2)]-[β-d-glu-copyranosyl-(1→3)]-β-d-fucopyranoside |
|
C48H78O18 |
|
|
TCMBANKIN028105 |
γ- Cubeb oleyl |
|
|
|
|
TCMBANKIN029291 |
α- pepper ene |
|
|
|
|
TCMBANKIN032156 |
XIV(alkyl)acid |
|
|
|
|
TCMBANKIN034626 |
5,7,4'-trihydroxy-3'-methoxy-6,8-isopentenyl isoflavones |
|
|
|
|
TCMBANKIN034831 |
β- ethylenically arborvitae |
|
|
|
|
TCMBANKIN035469 |
Stearate |
|
C18H35O2- |
283.5 g/mol |
CCCCCCCCCCCCCCCCCC(=O)[O-] |
TCMBANKIN035683 |
Cubeb oleyl |
|
|
|
|
TCMBANKIN035906 |
α- arborvitae ene |
|
|
|
|
TCMBANKIN037504 |
β-Bisabolene |
(1S)-bisabola-4,7(11),10(15)-triene; (-)-beta-bisabolene; beta-Bisabolene; Cyclohexene, 1-methyl-4-(5-methyl-1-methylene-4-hexenyl)-, (S)-; (S)-(-)-6-methyl-2-(4-methyl-3-cyclohexen-1-yl)-1,5-heptadiene; LMPR0103060013; beta-bisabolene ; β-Bisabolene; UNII-S19BRC22QA; (1S)-bisabola-4,7(11),10(15)-triene (4S)-1-methyl-4-(5-methyl-1-methylenehex-4-en-1-yl)cyclohexene; 1-Methyl-4-(5-methyl-1-methylene-4-hexenyl)-1-cyclohexene-, (4S)-; (4R)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene; S19BRC22QA; XZRVRYFILCSYSP-OAHLLOKOSA-N; InChI=1/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,15H,4-5,7,9-11H2,1-3H; CHEBI:49263; C19751; 1-methyl-4-(5-methyl-1-methylenehex-4-en-1-yl)cyclohexene; (4R)-1-methyl-4-(5-methyl-1-methylene-hex-4-enyl)cyclohexene; cyclohexene, 1-methyl-4-(5-methyl-1-methylene-4-hexenyl)-; FT-0622892; (-)-.beta.-bisabolene; .beta.-Bisabolene; 495-61-4; β- bisabolene; (+,-)-.beta.-Bisabolene; (-)-b-bisabolene,b-bisabolene,6-methyl-2-(4-methyl-3-cyclohexen-1-yl)-1,5-heptadiene; (4R)-1-methyl-4-(5-methyl-1-methylenehex-4-enyl)cyclohexene; l-beta-Bisabolene; l-.beta.-Bisabolene; (S)-1-Methyl-4-(5-methyl-1-methylene-4-hexenyl)cyclohexene; beta-bisabolene; (S)-beta-bisabolene; (4S)-1-methyl-4-(5-methyl-1-methylenehex-4-en-1-yl)cyclohexene; CHEMBL1077088; C16775; ZINC1846611; 1-Methyl-4-(5-methyl-1-methylene-4-hexenyl)-(S)-cyclohexene; (s)-1-methyl-4-(5-methyl-1-methylene-4-hexenyl)-cyclohexene; 1,5-Heptadiene, 6-methyl-2-(4-methyl-3-cyclohexen-1-yl)-, (S)-(-)- |
|
204.35 g/mol |
|
TCMBANKIN039202 |
saikosaponin q |
|
C48H78O19 |
959 |
C1([H])([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])(C([H])=C([H])C(=C(C([H])([H])[C@](C([H])([H])O[H])(C([H])([H])[H])C([H])([H])C2([H])[H])[C@@]2(C([H])([H])O[H])[C@@]([H])(O[H])C3([H])[H])[C@@]34
C([H])([H])[H])[C@@]4(C([H])([H])[H])C([H])([H])C5([H])[H])[C@]5([H])[C@@](C([H])([H])O[H])(C([H])([H])[H])[C@@]1([H])O[C@]([H])(O[C@]6([H])C([H])([H])O[C@]([H])(O[C@]7([H])C([H])([H])O[H])[C@]([H])(O
[H])[C@@]([H])(O[H])[C@]7([H])O[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]6([H])O[C@]([H])(O[C@@]8([H])C([H])([H])[H])[C@]([H])(O[H])[C@]([H])(O[H])[C@@]8([H])O[H] |
TCMBANKIN041242 |
Saikosaponin O |
|
|
1121.3 g/mol |
|
TCMBANKIN042295 |
Saikosaponin P |
|
|
|
|
TCMBANKIN043469 |
γ-Elemene |
O-Menth-8-ene, 4-isopropylidene-1-vinyl-; 1-ethenyl-1-methyl-2-(1-methylethenyl)-4-(1-methylethylidene)-cyclohexane; γ- elemene; γ--elemene; γ-Elernene |
|
204.35 |
|
TCMBANKIN045225 |
Saikosaponin t |
AC1O3DXV; (2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-4-hydroxy-5-[[8-hydroxy-8a-(hydroxymethyl)-14-methoxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-2,5-bis(hydroxymethyl)oxolan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; saikosaponin t |
|
813.15 |
CC1(CCC2(C(C1)C3=CC(C4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)C)OC6(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)O)O)O)CO)C)OC)CO)C |
TCMBANKIN046602 |
saikogenin q |
|
C31H50O5 |
|
CC1(CCC2(C(CC3(C(=C2C1)C=CC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C)O)CO)CCO |
TCMBANKIN058149 |
isoluteolin |
orobol; 5,7,3 ', 4'-tetrahydroxy isoflavone; Santol |
C15H10O6 |
286.24 g/mol |
C1=CC(=C(C=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O)O |
TCMBANKIN059272 |
diisobutyl phthalate |
di-isobutyl phthalate;ST5405544; diisobutyl benzene-1,2-dicarboxylate; benzene-1,2-dicarboxylic acid diisobutyl ester; Di-iso-butyl phthalate; 80130_FLUKA; Isobutyl phthalate; bis(2-methylpropyl) benzene-1,2-dicarboxylate; (C4-C13) Branched alkyl alcohols, phthalic anhydride ester; ZINC00388318; EINECS 201-553-2; NSC15316; 1,2-Benzenedicarboxylic acid, bis(2-methylpropyl) ester; Diisobutyl phthalate; 152641_ALDRICH; EINECS 273-157-8; 68951-39-3; C15205; AI3-04278; Phthalic acid, diisobutyl ester; BRN 2054802; NCGC00091360-01; NSC 15316; WLN: 1Y1&1OVR BVO1Y1&1; 4-09-00-03177 (Beilstein Handbook Reference); Diisobutylester kyseliny ftalove [Czech]; Hexaplas M/1B; 1,2-Benzenedicarboxylic acid, C4-13-branched alkyl esters; AI3-04278 (USDA); Kodaflex DIBP; 68955-80-6; Hatcol DIBP; HSDB 5247; CCRIS 6193; di-l-butyl phthalate (DIBP); Di(i-butyl)phthalate; SMR000112470; MLS000516002; 84-69-5; Palatinol IC |
C16H22O4- C6H4[CO2CH2CH(CH3)2]2 |
278.34 g/mol |
CC(C)COC(=O)C1=CC=CC=C1C(=O)OCC(C)C |
TCMBANKIN059511 |
Benihinal |
|
C10H14O |
150.22 g/mol |
CC1(C2CC=C(C1C2)C=O)C |
TCMBANKIN059521 |
B- pinene;pinene;T-pinene;(-)-nopinene;beta-pinene;bicyclo[3.1.1]heptane,6,6-dimethyl-2-methylene-,(1s);1-β-pinene;()-beta-Pinene;(-)- β- pinene;laevo- β- Pinene |
|
C10H16 |
136.23 g/mol |
CC1(C2CCC(=C)C1C2)C |
TCMBANKIN059536 |
α-fenchene |
|
C10H16 |
136.23 g/mol |
CC1(C2CCC1C(=C)C2)C |
TCMBANKIN059976 |
humulene |
|
C15H24 |
204.35 g/mol |
CC1=CCC(C=CCC(=CCC1)C)(C)C |
TCMBANKIN059980 |
4-methyl-1-isopropyl-3-cyclohexen-1-ol |
|
C10H18O |
154.25 g/mol |
CC1=CCC(CC1)(C(C)C)O |
TCMBANKIN059983 |
β-bisabolene |
|
C15H24 |
204.35 g/mol |
CC1=CCC(CC1)C(=C)CCC=C(C)C |
TCMBANKIN059985 |
alpha-terpinol |
|
C10H18O |
154.25 g/mol |
CC1=CCC(CC1)C(C)(C)O |
TCMBANKIN060244 |
saikosaponin b3 |
|
C42H68O13 |
781 g/mol |
CC1C(C(C(C(O1)OC2CCC3(C(C2(C)CO)CCC4(C3C=CC5=C6CC(CCC6(C(CC54C)O)CO)(C)C)C)C)O)OC7C(C(C(C(O7)CO)O)O)O)O |
TCMBANKIN060247 |
Saikosaponin D |
|
C42H68O13 |
780.98g/mol |
CC1C(C(C(C(O1)OC2CCC3(C(C2(C)CO)CCC4(C3C=CC56C4(CC(C7(C5CC(CC7)(C)C)CO6)O)C)C)C)O)OC8C(C(C(C(O8)CO)O)O)O)O |
TCMBANKIN060440 |
pulegone |
|
C10H16O |
152.23 g/mol |
CC1CCC(=C(C)C)C(=O)C1 |
TCMBANKIN060958 |
oleic acid;cis-oleic acid;oleinic acid |
|
C18H34O2 |
282.46 |
CCCCCCCCC=CCCCCCCCC(=O)O |