TCMBANKIN000020 |
ailanthone |
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C20H24O7 |
376.4 g/mol |
CC1=CC(=O)C(C2(C1CC3C45C2C(C(C(=C)C4CC(=O)O3)O)(OC5)O)C)O |
TCMBANKIN000204 |
neoquassin |
|
C22H30O6 |
390.5 g/mol |
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(O3)O)C)OC)C)C)OC |
TCMBANKIN002264 |
altissimacouniarin B |
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C21H26O6 |
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CC(=CCCC1(C(O1)COC2=C(C=C3C=CC(=O)OC3=C2OC)OC)C)C |
TCMBANKIN005929 |
2,6-dimethoxy-p-cresol |
|
C9H12O3 |
168.19 g/mol |
CC1=CC(=C(C(=C1)OC)O)OC |
TCMBANKIN006056 |
cabralealactone |
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C27H42O3 |
414.6 g/mol |
CC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC4C5(CCC(=O)O5)C)C)C)C |
TCMBANKIN007977 |
Amarolide |
AIDS-026413; Picrasane-1,12,16-trione, 2,11-dihydroxy-, (2.alpha.,11.alpha.)-; (2alpha,11alpha)-2,11-Dihydroxypicrasane-1,12,16-trione; 29913-86-8; amarolide; AIDS026413; Picrasane-1,12,16-trione, 2,11-dihydroxy-, (2alpha,11alpha)-; (2.alpha.,11.alpha.)-2,11-Dihydroxypicrasane-1,12,16-trione |
C20H28O6 |
364.43 |
CC1CC(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(=O)O3)C)O)C)C)O |
TCMBANKIN010092 |
betulafolienediolone |
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|
|
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TCMBANKIN010674 |
shionone |
(1R,4aS,4bS,6aS,8R,10aR,10bS,12aS)-1,4b,6a,8,10a,12a-hexamethyl-8-(4-methylpent-3-en-1-yl)hexadecahydrochrysen-2(1H)-one; UNII-BT0AMD31UB; Shionone; 10376-48-4; N2225; CHEBI:63459; BT0AMD31UB; Shionon; AKOS030573546; 2(1H)-Chrysenone,hexadecahydro-1,4b,6a,8,10a,12a-hexamethyl-8-(4-methyl-3-penten-1-yl)-,(1R,4aS,4bS,6aS,8R,10aR,10bS,12aS)-; D:A-Friedo-18,19-secolup-19-en-3-one; 376S484; C17966; ZINC6037228; AK608266; MolPort-020-005-764; FT-0697220; Ambap10376-48-4 |
C30H50O |
426.72 |
CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC(C4)(C)CCC=C(C)C)C)C)C)C |
TCMBANKIN012407 |
24,25-dihydroxydammar-20-en-3-one |
|
C30H50O3 |
458.7 g/mol |
CC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC4C(=C)CCC(C(C)(C)O)O)C)C)C |
TCMBANKIN013417 |
altissimacouniarin G |
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C21H26O7 |
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CC(=CC1CC(C(O1)COC2=C(C=C3C=CC(=O)OC3=C2OC)OC)(C)O)C |
TCMBANKIN014960 |
altissimanins B |
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C30H50O3 |
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CC(CCC(C(C)(C)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C |
TCMBANKIN016778 |
altissimanins D |
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C60H98O7 |
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CC(CC(C(C(C)(C)O)OC(=O)CCC1(C2CCC3(C(CCC3(C2CCC1C(=C)C)C)C4(CCC(O4)C(C)(C)O)C)C)C)O)C5CCC6(C5(CCC7C6=CCC8C7(CCC(=O)C8(C)C)C)C)C |
TCMBANKIN017557 |
altissimanins E |
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C60H98O7 |
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CC(CC(C(C(C)(C)O)O)OC(=O)CCC1(C2CCC3(C(CCC3(C2CCC1C(=C)C)C)C4(CCC(O4)C(C)(C)O)C)C)C)C5CCC6(C5(CCC7C6=CCC8C7(CCC(=O)C8(C)C)C)C)C |
TCMBANKIN017677 |
chasmanine |
|
C25H41NO6 |
451.6 |
CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6CC4C5C6O)OC)O)OC)OC)COC |
TCMBANKIN017965 |
ailanthinone |
|
C25H34O9 |
478.5 g/mol |
CCC(C)C(=O)OC1C2C(C(C3(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C |
TCMBANKIN019056 |
20(S)-hydroxy-25-melhoxydainmar-23-en-3-one |
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C13H9NO3S |
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C1=CSC(=C1)C=CC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
TCMBANKIN019173 |
bourjotinolone B |
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C30H48O3 |
456.7 g/mol |
CC(CC(C(C(=C)C)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C |
TCMBANKIN024140 |
Quassin |
Picrasa-2,12-diene-1,11,16-trione, 2,12-dimethoxy-; 1405-17-0; LMPR01060018; quassin; (3AS,6aR,7aS,8S,11aS,11bS,11cS)-1,3a,4,5,6a,7,7a,8,11,11a,11b,11c-dodecahydro-2,10-dimethoxy-3,8,11a,11c-tetramethyldibenzo(de,g)chromene-1,5,11-trione; C08778; 76-78-8; Quassine; 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione; EINECS 200-985-9; AIDS026399; NSC 36342; AIDS-026399 |
C22H28O6 |
388.45 |
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(=O)O3)C)OC)C)C)OC |
TCMBANKIN025680 |
altissimanins A |
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TCMBANKIN025946 |
altissimacouniarin D |
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C21H26O5 |
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CC(=CCCC(=CCOC1=C(C=C2C=CC(=O)OC2=C1OC)OC)C)C |
TCMBANKIN026070 |
Shinjulactone K |
94451-22-6; Picrasane-1,16-dione, 12-(actyloxy)-2,12-dihydroxy-, (2.alpha.,11.alpha.,12.alpha.); AIDS-026415; Picrasane-1,16-dione, 12-(actyloxy)-2,12-dihydroxy-, (2alpha,11alpha,12alpha); shinjulactone k; AIDS026415 |
C22H32O7 |
408.49 |
CC1CC(C(=O)C2(C1CC3C4(C2C(C(C(C4CC(=O)O3)C)OC(=O)C)O)C)C)O |
TCMBANKIN027522 |
Cantleyine |
methyl (6S,7R)-6-hydroxy-7-methyl-6,7-dihydro-5H-cyclopenta[d]pyridine-4-carboxylate; C09933; cantleyine; 30333-81-4; (6S,7R)-6-hydroxy-7-methyl-2-pyrindan-4-carboxylic acid methyl ester; (6S,7R)-6-hydroxy-7-methyl-6,7-dihydro-5H-cyclopenta[d]pyridine-4-carboxylic acid methyl ester |
C11H13NO3 |
207.23 |
CC1C(CC2=C(C=NC=C12)C(=O)OC)O |
TCMBANKIN027860 |
chaparrinone |
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C20H26O7 |
378.4 g/mol |
CC1C2CC(=O)OC3C24COC(C1O)(C4C5(C(C3)C(=CC(=O)C5O)C)C)O |
TCMBANKIN029239 |
7α-hydroxy-sitosterol |
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TCMBANKIN032018 |
isofouquierone |
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C30H50O3 |
458.72 |
CC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC4C(C)(CC=CC(C)(C)O)O)C)C)C |
TCMBANKIN033014 |
(20S,24R)-12β,25-dihydroxy-20,24-epoxydammarane-3-one |
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C30H50O4 |
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CC1(C2CCC3(C(C2(CCC1=O)C)CC(C4C3(CCC4C5(CCC(O5)C(C)(C)O)C)C)O)C)C |
TCMBANKIN034458 |
altissimanins C |
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TCMBANKIN036948 |
neoschaftoside |
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C26H28O14 |
564.5 g/mol |
C1C(C(C(C(O1)C2=C3C(=C(C(=C2O)C4C(C(C(C(O4)CO)O)O)O)O)C(=O)C=C(O3)C5=CC=C(C=C5)O)O)O)O |
TCMBANKIN038176 |
2,3-Dimethoxy-9,10-dihydroxy-N-methyl-tetrahydroprotoberberine quaternary salt |
|
C20H24NO4 |
342.409 |
c1(OC([H])([H])[H])c([H])c(C([H])([H])C([H])([H])[N@@+](C([H])([H])[H])(C([H])([H])c(c(O[H])c(O[H])c([H])c2[H])c2C3([H])[H])[C@@]34[H])c4c([H])c1OC([H])([H])[H] |
TCMBANKIN038726 |
Niloticin |
CHEMBL460656 |
|
456.7 |
|
TCMBANKIN039180 |
Shinjudilactone |
shinjudilactone |
C20H24O7 |
376.4 |
CC1C2CC(=O)OC3C24COC(=O)C1(C4C5(C(C3)C(=CC(=O)C5O)C)C)O |
TCMBANKIN043657 |
Ailantinol E |
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388.4 g/mol |
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TCMBANKIN044098 |
Ailantinol F |
|
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362.4 g/mol |
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TCMBANKIN045421 |
canthin-6-one |
NSC 103003; MEGxp0_000046; canthin-6-one; 6H-Indolo(3,2,1-de)(1,5)naphthyridin-6-one; NCIOpen2_007333; AIDS228088; ACon0_001416; AIDS-228088; C09098; NSC103003; 479-43-6; 6H-Indolo[3,2,1-de][1,5]naphthyridin-6-one; ZINC00898052 |
C14H8N2O |
220.226 |
c1([H])c([H])c(c2c(c(nc([H])c2[H])C([H])=C([H])C3=O)n34)c4c([H])c1[H] |
TCMBANKIN048898 |
Ailantinol G |
|
|
480.5 g/mol |
|
TCMBANKIN058972 |
(23E)-3β,25-dihydroxytiriicalla-7,23-diene |
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C32H48O8 |
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CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(C4(C)C)O)O)C)C)C)O)O |
TCMBANKIN059316 |
SMR000232320 |
(5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-[(2S,4R,5S)-4,5,6-trihydroxy-6-methyl-heptan-2-yl]-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one; (5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-[(2S,4R,5S)-4,5,6-trihydroxy-6-methylheptan-2-yl]-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one; MLS000563510; (5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-[(1S,3R,4S)-3,4,5-trihydroxy-1,5-dimethylhexyl]-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one; (5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-[(1S,3R,4S)-3,4,5-trihydroxy-1,5-dimethyl-hexyl]-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one;piscidinol a |
C30H50O4 |
474.7 g/mol |
CC(CC(C(C(C)(C)O)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C |
TCMBANKIN060394 |
Amarolide 11-acetate |
|
C22H30O7 |
406.5 g/mol |
CC1CC(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(=O)O3)C)OC(=O)C)C)C)O |
TCMBANKIN060687 |
Hydroxysitosterol |
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C29H50O2 |
430.71 |
CCC(CCC(C)C1CCC2C1(CCC3C2C(C=C4C3(CCC(C4)O)C)O)C)C(C)C |
TCMBANKIN061900 |
1-methoxycanthin-6-one |
1-Methoxycanthinone; AIDS104956; 6H-Indolo(3,2,1-de)(1,5)naphthyridin-6-one, 1-methoxy-; AIDS-104956; 60755-86-4; 1-Methoxy-6H-indolo(3,2,1-de)(1,5)naphthyridin-6-one; 1-Methoxy-indolo[3,2,1-de][1,5]naphthyridin-6-one |
C15H10N2O2 |
250.25 |
COC1=CN=C2C=CC(=O)N3C2=C1C4=CC=CC=C43 |
TCMBANKIN061901 |
pinitol |
Pinitol; ZINC3978754; ZINC242463987; ononitol; A800629; P2219; 60537-25-9; CTK5B1658; MLS002639102; Oprea1_249757; BG01510465; Quebrachitol; Pinitol, (+)-; SCHEMBL24537; NSC26254; Quebrachitol, (-)-; NSC-231332; Ononitol; 1-Methoxycyclohexane-2,3,4,5,6-pentaol; D-4-O-Methyl-myo-inositol; Inositol, L-chiro-; NSC128700; NSC-43336; L-chiro-Inositol, 2-O-methyl-; MolPort-023-220-422; NSC231332; 2-O-methyl-l-inositol; N934; MCULE-7951850879; Matezit; AKOS024283476; ST069274; AS-15082; NCGC00095666-01; SMR001548553; 6-methoxycyclohexane-1,2,3,4,5-pentaol; (3S,6S)-6-METHOXYCYCLOHEXANE-1,2,3,4,5-PENTOL; 2-0-methyl-chiro-inositol; VC30824; Pinite (inositol derivative); NSC-128700; NSC-131046; NSC-26254; Quebrachit; AC1L5KHM; CHEMBL171890; 4CN-0916; NSC131046; AC1Q79P1; (1r,2s,3s,4s,5s,6r)-6-methoxycyclohexane-1,2,3,4,5-pentaol; 6-methoxycyclohexane-1,2,3,4,5-pentol; NSC43336; epi-Inositol,6-O-methyl- (9CI); Sennit; l-quebrachitol |
C7H14O6 |
194.18 g/mol |
COC1C(C(C(C(C1O)O)O)O)O |