TCMBANKIN000027 |
taxol |
Paclitaxel |
C47H51NO14 |
853.91 |
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C |
TCMBANKIN000927 |
taxinine b |
|
C37H44O11 |
664.7 g/mol |
CC1=C2C(C(C3(C(CC(C(=C)C3C(C(C2(C)C)CC1=O)OC(=O)C)OC(=O)C=CC4=CC=CC=C4)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN001436 |
taxumairol d |
|
C30H42O13 |
610.6 g/mol |
CC1=C2C(C(C3(C(CC(C4(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C)CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)O |
TCMBANKIN003484 |
taxol b |
|
C45H53NO14 |
831.9 g/mol |
CC=C(C)C(=O)NC(C1=CC=CC=C1)C(C(=O)OC2CC3(C(C4C(C(CC5C4(CO5)OC(=O)C)O)(C(=O)C(C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)C6=CC=CC=C6)O)O |
TCMBANKIN004311 |
taxuyunnanine b |
|
C33H48O10 |
|
CCC(C)C(=O)OC1CC(=C2C(C(C3(CCC(C(=C)C3C(C1C2(C)C)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C)C |
TCMBANKIN004576 |
7-epitaxuyunnanine a |
|
C46H57NO14 |
|
|
TCMBANKIN005152 |
19-hydroxybaccatin iii |
|
C31H38O12 |
602.6 g/mol |
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)CO)OC(=O)C |
TCMBANKIN005259 |
7,9-diacetyltaxayuntin |
|
C31H40O11 |
|
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C)(CO4)OC(=O)C)O)C)O)OC(=O)C5=CC=CC=C5 |
TCMBANKIN005374 |
taxuspine x |
|
C41H50O14 |
766.8 g/mol |
CC1=C2C(C(=C(C(CC(C(=CC(C(C2(C)C)CC1OC(=O)C)OC(=O)C)COC(=O)C)OC(=O)C=CC3=CC=CC=C3)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN007522 |
yunnanxol |
|
C40H46O14 |
750.8 g/mol |
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)O)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)OC(=O)C |
TCMBANKIN008189 |
yuzhizioside |
|
C52H84O21 |
|
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)OC7C(C(C(CO7)O)O)O)C)C)C2C1)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C |
TCMBANKIN008367 |
10-deacetylbaccatin vi |
|
C35H44O13 |
672.7 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)O |
TCMBANKIN010373 |
9-deacetylbaccatin vi |
|
C35H44O13 |
672.7 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)OC(=O)C)C)O)OC(=O)C |
TCMBANKIN012074 |
taxayuntin d |
|
C47H50O14 |
|
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1OC(=O)C)C(C)(C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7 |
TCMBANKIN014725 |
taxuyunnanine i |
|
C26H40O6 |
448.6 g/mol |
CC1=C2C(CC3(CCC(C(=C)C3C(C(C2(C)C)C(C1)OC(=O)C(C)C)OC(=O)C)O)C)O |
TCMBANKIN014916 |
taxayuntin |
|
C35H44O13 |
672.7 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C5=CC=CC=C5 |
TCMBANKIN015056 |
5,7,4'-trihydroxy-6-c-glucoside-8-c-arabinosideflavone |
5,7,4'-trihydroxy-6-c-glucoside-8-c-arabinoside flavone |
|
|
C1C(C(C(C(O1)C2=C(C(=C(C3=C2OC(=CC3=O)C4=CC=C(C=C4)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O)O)O |
TCMBANKIN015168 |
taxayuntin f |
|
C33H42O12 |
|
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C5=CC=CC=C5)O |
TCMBANKIN015462 |
7-epi-10-deacetyltaxuyunnanine a |
|
C44H55NO13 |
|
|
TCMBANKIN015760 |
yunnanxane |
|
C31H46O9 |
562.7 g/mol |
CC1=C2C(CC3(CCC(C(=C)C3C(C(C2(C)C)C(C1)OC(=O)C(C)C(C)O)OC(=O)C)OC(=O)C)C)OC(=O)C |
TCMBANKIN016081 |
taxuyunnanine h |
|
C25H38O6 |
434.6 g/mol |
CCC(=O)OC1CC(=C2C(CC3(CCC(C(=C)C3C(C1C2(C)C)OC(=O)C)O)C)O)C |
TCMBANKIN016612 |
1beta-hydroxybaccatin i |
1β-hydroxybaccatin i |
C32H44O14 |
652.7 g/mol |
CC1=C2C(C(C3(C(CC(C4(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C)CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN016669 |
2α,5α,14β-triacetoxy-10β-o-(β-d-glucopyra-nosyl)taxa-4(20),11-diene |
|
|
|
C32H48O12 |
TCMBANKIN016697 |
taxininen,n-4 |
|
C35H42O10 |
|
CC(=O)OC1C2CC(=O)C3(C(C2(C)C)(O3)C(C(C4(C1C(=C)C(CC4)OC(=O)C=CC5=CC=CC=C5)C)OC(=O)C)OC(=O)C)C |
TCMBANKIN017100 |
baccatin ii |
|
C31H38O11 |
|
|
TCMBANKIN017329 |
decodine |
|
C25H29NO5 |
|
COC1=C(C2=C(C=C1)C3CC(CC4C3NCCC4)OC(=O)CCC5=CC2=C(C=C5)O)O |
TCMBANKIN017816 |
tazettine |
|
C18H21NO5 |
331.4 g/mol |
CN1CC2(C3(C1CC(C=C3)OC)C4=CC5=C(C=C4CO2)OCO5)O |
TCMBANKIN018846 |
taxuyunnanine f |
|
C30H42O13 |
610.6 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1OC(=O)C)C(C)(C)O)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)O |
TCMBANKIN019886 |
10-deacetyl-10-oxo-7-epitaxuyunnanine a |
|
C44H53NO13 |
|
CCCCCC(=O)NC(C1=CC=CC=C1)C(C(=O)OC2CC3(C(C4C(C(CC5C4(CO5)OC(=O)C)O)(C(=O)C(=O)C(=C2C)C3(C)C)C)OC(=O)C6=CC=CC=C6)O)O |
TCMBANKIN020501 |
taxol c |
|
C46H57NO14 |
847.9 g/mol |
CCCCCC(=O)NC(C1=CC=CC=C1)C(C(=O)OC2CC3(C(C4C(C(CC5C4(CO5)OC(=O)C)O)(C(=O)C(C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)C6=CC=CC=C6)O)O |
TCMBANKIN021597 |
o-deacetylpachysandrine b |
|
C29H50N2O2 |
|
CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4O)N(C)C(=O)C=C(C)C)C)C)N(C)C |
TCMBANKIN021854 |
taxuyunnanine g |
|
C24H36O6 |
420.5 g/mol |
CC1=C2C(CC3(CCC(C(=C)C3C(C(C2(C)C)C(C1)O)OC(=O)C)OC(=O)C)C)O |
TCMBANKIN022404 |
taxinine j |
|
C39H48O12 |
708.8 g/mol |
CC1=C2C(C(C3(C(CC(C(=C)C3C(C(C2(C)C)CC1OC(=O)C)OC(=O)C)OC(=O)C=CC4=CC=CC=C4)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN023129 |
taxayuntin g |
|
C28H42O12 |
570.6 g/mol |
CC1=C2C(C(C3(C(CC(C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C)CO)OC(=O)C)OC(=O)C)C)OC(=O)C)O |
TCMBANKIN023228 |
taxayunnansin a |
|
C35H44O13 |
672.7 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C5=CC=CC=C5 |
TCMBANKIN023546 |
1-hydroxy-2,7,9-trideacetylbaccatin i |
|
C26H38O11 |
|
CC1=C2C(C(C3(C(CC(C4(C3C(C(C2(C)C)(CC1OC(=O)C)O)O)CO4)OC(=O)C)O)C)O)OC(=O)C |
TCMBANKIN023894 |
taxuyunnanine c |
|
C28H40O8 |
504.6 g/mol |
CC1=C2C(CC3(CCC(C(=C)C3C(C(C2(C)C)C(C1)OC(=O)C)OC(=O)C)OC(=O)C)C)OC(=O)C |
TCMBANKIN023898 |
epitulipinolide |
epi-tulipinolide |
C17H22O4 |
290.4 g/mol |
CC1=CC2C(C(CC(=CCC1)C)OC(=O)C)C(=C)C(=O)O2 |
TCMBANKIN023913 |
taxusin |
|
C28H40O8 |
504.6 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3CC(C2(C)C)CC1OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN023928 |
7,9-deacetylbaccatin vi |
|
C33H42O12 |
|
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O)OC(=O)C |
TCMBANKIN024881 |
yunantaxusin a |
|
C35H46O14 |
690.7 g/mol |
CC1=C2C(C(C3(C(CC(C(C3C(C2(CC1O)C(C)(C)O)O)(COC(=O)C)O)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C4=CC=CC=C4 |
TCMBANKIN025497 |
taxuyunnanine j |
|
C22H34O4 |
362.5 g/mol |
CC1=C2C(CC3(CCC(C(=C)C3CC(C2(C)C)C(C1)O)OC(=O)C)C)O |
TCMBANKIN025966 |
7,9-deacetylbaccatin iv |
|
C28H40O12 |
|
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C)(CO4)OC(=O)C)O)C)O)OC(=O)C |
TCMBANKIN026077 |
2-deacetoxy-5-decinnamoyl taxinin j |
|
C28H40O9 |
|
|
TCMBANKIN026264 |
1-dehydroxybaccatin iii |
|
C31H38O10 |
|
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)CC1O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)OC(=O)C |
TCMBANKIN026299 |
taxayuntin c |
|
C42H48O14 |
776.8 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1OC(=O)C)C(C)(C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C6=CC=CC=C6 |
TCMBANKIN028137 |
10-deacetyl baccatin iii |
|
C29H36O10 |
544.6 g/mol |
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O |
TCMBANKIN032444 |
taxinine k |
|
C26H36O8 |
|
CC1C(=O)CC2C(C34C1(C2(C)C)C(C(C3(CCC(C4=C)O)C)OC(=O)C)OC(=O)C)OC(=O)C |
TCMBANKIN033611 |
taxol d |
|
C44H53NO14 |
819.9 g/mol |
CCCC(=O)NC(C1=CC=CC=C1)C(C(=O)OC2CC3(C(C4C(C(CC5C4(CO5)OC(=O)C)O)(C(=O)C(C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)C6=CC=CC=C6)O)O |
TCMBANKIN033943 |
taxuyunnanine d |
|
C24H34O5 |
|
CC1=C2C(=O)CC3(CCC(C(=C)C3CC(C2(C)C)CC1OC(=O)C)OC(=O)C)C |
TCMBANKIN034372 |
taxinine |
|
C35H42O9 |
606.7 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)CC1=O)OC(=O)C)OC(=O)C=CC4=CC=CC=C4)C)OC(=O)C)OC(=O)C |
TCMBANKIN036030 |
1β-acetoxy-11,12-epoxy-6-drimen-8α,11α-diol |
|
C17H26O5 |
|
CC(=O)OC1CCC(C2C1(C3C(OCC3(C=C2)O)O)C)(C)C |
TCMBANKIN036974 |
1beta-dehydroxybaccatin iv |
1β-dehydroxybaccatin iv |
C32H44O13 |
|
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)CC1OC(=O)C)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN037079 |
10-Deacetyltaxuyunnanine A |
|
|
|
|
TCMBANKIN037429 |
Taxoline |
|
C45H55NO14 |
833.9 g/mol |
C1(=C(C([H])([H])[H])[C@@]([H])(OC(=O)[C@@]([H])(O[H])[C@]([H])(N([H])C([C@@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])[H])=O)c2c([H])c([H])c([H])c([H])c2[H])C3([H])[H])C(C([H])([H])[H])(C([H])([H])[
H])[C@]3(O[H])[C@@]([H])(OC(=O)c4c([H])c([H])c([H])c([H])c4[H])[C@]5([H])[C@@](C([H])([H])[H])([C@]([H])(O[H])C([H])([H])[C@@]([H])(OC6([H])[H])[C@]56OC(=O)C([H])([H])[H])C(=O)[C@]1([H])OC(=O)C([H])([
H])[H] |
TCMBANKIN037449 |
1β-Acetoxy-7-drimen-11α-ol-12,11-lactone |
|
|
|
|
TCMBANKIN038254 |
isotaxiresinol |
|
C19H22O6 |
346.4 g/mol |
COC1=C(C=C2C(C(C(CC2=C1)CO)CO)C3=CC(=C(C=C3)O)O)O |
TCMBANKIN038395 |
decinnamoyltaxinine b 11,12-oxide |
|
C28H38O11 |
|
CC(=O)OC1CC(C(=C)C2C1(C(C(C34C(C(C2OC(=O)C)CC(=O)C3(O4)C)(C)C)OC(=O)C)OC(=O)C)C)O |
TCMBANKIN038460 |
2α-hydroxy-7β,9α,10β,13α-tetraacetoxy-5α-(2'-hydroxy-3'-n,n-dimethylamino-3'-phenyl)-propionyloxytaxa-4(20),11-diene |
|
C39H53NO12 |
|
|
TCMBANKIN038675 |
taxinine h |
|
C28H38O9 |
|
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)CC1=O)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN039522 |
Dantaxusin D |
|
|
666.8 g/mol |
|
TCMBANKIN039897 |
(7'r)-7'-hydroxylariciresinol |
|
C20H24O7 |
|
COC1=C(C=CC(=C1)C2C(C(CO2)C(C3=CC(=C(C=C3)O)OC)O)CO)O |
TCMBANKIN039939 |
taxezopidine g |
|
C35H44O9 |
608.7 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)CC1OC(=O)C)O)OC(=O)C=CC4=CC=CC=C4)C)OC(=O)C)OC(=O)C |
TCMBANKIN039949 |
9-deacetyl-9-benzoyl-10-debenzoyl brevifoliol |
9-deacetyl-9-benzoyl-10-debenzoylbrevifoliol |
C29H38O8 |
|
CC1=C2C(C(C3(C(CC(C(=C)C3CC2(CC1O)C(C)(C)O)O)OC(=O)C)C)OC(=O)C4=CC=CC=C4)O |
TCMBANKIN039958 |
7-(β-xylosyl)taxol d |
|
C49H61NO18 |
|
|
TCMBANKIN039974 |
Baccatin III |
|
|
586.6 g/mol |
|
TCMBANKIN040196 |
13-decinnamoyl-9-deacetyltaxchinin b |
|
C33H42O12 |
630.7 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)O)OC(=O)C5=CC=CC=C5 |
TCMBANKIN040643 |
taxayuntin a |
|
C36H42O11 |
|
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)OC(=O)C6=CC=CC=C6)C)O)O |
TCMBANKIN041824 |
7-(β-Xylosyl)-10-deacetylbaccatin III |
|
|
|
|
TCMBANKIN042187 |
2'-Deacetoxyaustrotaxine |
|
|
709.8 g/mol |
|
TCMBANKIN042316 |
7-xylosyl-10-deacetylbaccatin iii |
|
C34H44O14 |
676.7 g/mol |
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)OC6C(C(C(CO6)O)O)O)C)O |
TCMBANKIN042739 |
deacetoxyvinblastine |
|
C43H54N4O7 |
|
CCC1(CC2CC(C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)C78CCN9C7C(CC(C8N6)(C(=O)OC)O)(C=CC9)CC)OC)C(=O)OC)O |
TCMBANKIN043070 |
Taxumairol E |
|
C30H44O12 |
596.7 g/mol |
C1(=C(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C2([H])[H])C(C([H])([H])[H])(C([H])([H])[H])[C@]2([H])[C@@]([H])(O[H])[C@]([H])([C@]([H])(C([H])([H])O[H])[C@@]([H])(OC(=O)C([H])([H])[H])C([H])([H
])[C@]3([H])OC(=O)C([H])([H])[H])[C@]3(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]1([H])OC(=O)C([H])([H])[H] |
TCMBANKIN043114 |
1beta-acetylbaccatin iv |
1β-acetylbaccatin iv |
C34H46O15 |
|
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)OC(=O)C)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN043260 |
5-dehydrokarounidiol |
|
C30H46O2 |
438.7 g/mol |
CC1(C(CCC2(C1=CC=C3C2=CCC4(C3(CCC5(C4CC(CC5)(C)CO)C)C)C)C)O)C |
TCMBANKIN043760 |
Taxuspine C |
|
|
606.7 g/mol |
|
TCMBANKIN043782 |
taxuyunnanine q |
|
C26H40O11 |
528.6 g/mol |
CC1=C2C(C(C3(C(CC(C(C3C(C2(CC1O)C(C)(C)O)O)CO)O)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN043832 |
p-hydroxybenzaldehyde |
p-hydroxybenz-aldehyde; 298704-22-0; p- hydroxybenzaldehyde; SCHEMBL13804892; p-hydroxy benzaldehyde; 4-hydroxy-[2,3,5,6,7-2H5]-benzaldehyde; p-hydroxy-benzaldehyde; p-HBAld |
C7H6O2 |
127.15 g/mol |
C1=CC(=CC=C1C=O)O |
TCMBANKIN043860 |
Hongdoushan C |
|
|
462.6 g/mol |
|
TCMBANKIN043866 |
taxuyunnanine p |
|
C24H38O10 |
486.6 g/mol |
CC1=C2C(C(C3(C(CC(C(C3C(C2(CC1O)C(C)(C)O)O)CO)O)OC(=O)C)C)OC(=O)C)O |
TCMBANKIN043903 |
taxayuntin j |
|
C30H44O13 |
612.7 g/mol |
CC1=C2C(C(C3(C(CC(C(C3C(C2(CC1O)C(C)(C)O)O)COC(=O)C)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN043978 |
Taxuspinanane A |
|
C47H59NO14 |
862 g/mol |
C1(=C(C([H])([H])[H])[C@@]([H])(OC(=O)[C@]([H])(O[H])[C@@]([H])(N([H])C(=O)C([H])([H])C([H])([H])[C@]([H])(C([H])([H])C([H])([H])[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])C3([H])[H])C(C([H])(
[H])[H])(C([H])([H])[H])[C@]3(O[H])[C@]([H])(OC(=O)c4c([H])c([H])c([H])c([H])c4[H])[C@]([H])([C@@]5(OC(=O)C([H])([H])[H])[C@@]([H])(OC5([H])[H])C([H])([H])[C@@]6([H])O[H])[C@]6(C([H])([H])[H])C(=O)[C@
]1([H])OC(C([H])([H])[H])=O |
TCMBANKIN044255 |
10-Deacetyltaxuyunnanine C |
|
|
|
|
TCMBANKIN044283 |
Taxezopidine H |
|
|
608.7 g/mol |
|
TCMBANKIN044428 |
10β-acetoxy-2α,5α,7β,9α-tetrahydroxytaxa-4(20),11-dien-13-one |
|
C22H32O7 |
|
CC1=C2C(C(C3(C(CC(C(=C)C3C(C(C2(C)C)CC1=O)O)O)O)C)O)OC(=O)C |
TCMBANKIN044605 |
2alpha,10beta-Trihydroxy-5alpha-acetoxytaxa-4(20),11-diene |
|
C22H34O5 |
|
[C@@]1([H])(O[H])C([H])([H])[C@@]2(C([H])([H])[H])[C@@]([H])(C(=C([H])[H])[C@@]([H])(OC(C([H])([H])[H])=O)C([H])([H])C2([H])[H])[C@]([H])(O[H])[C@@]3([H])C(C([H])([H])[H])(C([H])([H])[H])C1=C(C([H])([
H])[H])C([H])([H])[C@]3([H])O[H] |
TCMBANKIN045039 |
10-Deactyl taxinine B |
|
C35H42O10 |
|
[C@@]12(C([H])([H])[H])[C@]([H])([C@]([H])(OC(=O)C([H])([H])[H])[C@]3([H])C(C([H])([H])[H])(C([H])([H])[H])C(=C(C([H])([H])[H])C(=O)C3([H])[H])[C@@]([H])(O[H])[C@]1([H])OC(=O)C([H])([H])[H])C(=C([H])[
H])[C@@]([H])(OC(=O)\C([H])=C([H])/c4c([H])c([H])c([H])c([H])c4[H])C([H])([H])[C@]2([H])OC(=O)C([H])([H])[H] |
TCMBANKIN045059 |
taxuchin a |
|
C32H44O14 |
|
CC1=C2C(C(C3(C(CC(C4(C3C(C2(CC1OC(=O)C)C(C)(C)O)OC(=O)C)CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN045154 |
taxiresinol |
|
C19H22O6 |
346.4 g/mol |
COC1=C(C=CC(=C1)CC2COC(C2CO)C3=CC(=C(C=C3)O)O)O |
TCMBANKIN045359 |
taxol c-7-xylose |
|
C50H61NO18 |
|
CC=C(C)C(=O)NC(C1=CC=CC=C1)C(C(=O)OC2CC3(C(C4C(C(CC5C4(CO5)OC(=O)C)OC6C(C(C(CO6)O)O)O)(C(=O)C(C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)C7=CC=CC=C7)O)O |
TCMBANKIN045410 |
yunnanxamine |
|
C47H53NO14 |
855.9 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)O)OC(=O)C |
TCMBANKIN045651 |
α-conidendrin |
|
C20H20O6 |
|
COC1=C(C=C2C(C3COC(=O)C3CC2=C1)C4=CC(=C(C=C4)O)OC)O |
TCMBANKIN045906 |
Taxayuntin B |
|
C31H40O11 |
|
C1(=C(C([H])([H])[H])[C@@]([H])(O[H])C2([H])[H])[C@]2(C(C([H])([H])[H])(C([H])([H])[H])O[H])[C@]([H])(OC(=O)C([H])([H])[H])[C@@]3([H])[C@@](C([H])([H])[H])([C@@]([H])(OC(=O)c4c([H])c([H])c([H])c([H])c
4[H])C([H])([H])[C@@]([H])(OC5([H])[H])[C@]35OC(=O)C([H])([H])[H])[C@@]([H])(O[H])[C@]1([H])O[H] |
TCMBANKIN045909 |
1-Acetoxy-baccatin I |
|
|
|
|
TCMBANKIN046455 |
baccatin iv |
|
C32H44O14 |
652.7 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN046584 |
7-(beta-Xylosyl)-10-deacetyltaxol |
7-(β-xylosyl)-10-deacetyltaxol |
C50H57NO17 |
|
C1(=C(C([H])([H])[H])[C@@]([H])(OC(=O)[C@]([H])(O[H])[C@@]([H])(N([H])C(=O)c2c([H])c([H])c([H])c([H])c2[H])c3c([H])c([H])c([H])c([H])c3[H])C4([H])[H])C(C([H])([H])[H])(C([H])([H])[H])[C@]4(O[H])[C@]([
H])(OC(=O)c5c([H])c([H])c([H])c([H])c5[H])[C@@]6([H])[C@@](C([H])([H])[H])([C@]([H])(O[C@]7([H])OC([H])([H])[C@]([H])(O[H])[C@]([H])(O[H])[C@@]7([H])O[H])C([H])([H])[C@@]([H])(OC8([H])[H])[C@]68OC(=O)
C([H])([H])[H])C(=O)[C@]1([H])O[H] |
TCMBANKIN046736 |
Hongdoushan B |
|
|
476.6 g/mol |
|
TCMBANKIN046926 |
hongdoushan a |
|
C29H44O7 |
504.7 g/mol |
CCC(C)C(=O)OC1CC(=C2C(CC3(CCC(C(=C)C3C(C1C2(C)C)OC(=O)C)OC(=O)C)C)O)C |
TCMBANKIN047244 |
Taxayuntin E |
|
C33H42O12 |
630.7 g/mol |
C1(C([H])([H])[H])=C([C@@]([H])(O[H])[C@]([H])(OC(=O)C([H])([H])[H])[C@](C([H])([H])[H])([C@]([H])(OC(=O)C([H])([H])[H])C([H])([H])[C@@]([H])(OC2([H])[H])[C@@]23OC(=O)C([H])([H])[H])[C@@]3([H])[C@@]4(
[H])OC(c5c([H])c([H])c([H])c([H])c5[H])=O)[C@@]4(C(O[H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])[C@]1([H])O[H] |
TCMBANKIN047271 |
2-Deacetyl-10-acetyltaxine B |
|
|
|
|
TCMBANKIN047489 |
Hyeroxytriacetoxytaxadiene |
|
C26H38O7 |
|
[C@]1([H])(OC(=O)C([H])([H])[H])C(=C(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C2([H])[H])C(C([H])([H])[H])(C([H])([H])[H])[C@@]2([H])C([H])([H])[C@]([H])(C(=C([H])[H])[C@@]([H])(O[H])C([H])([H])
C3([H])[H])[C@]3(C([H])([H])[H])[C@@]1([H])OC(=O)C([H])([H])[H] |
TCMBANKIN047811 |
Taxuyunnanine R |
|
|
508.6 g/mol |
|
TCMBANKIN048018 |
Dantaxusin B |
|
|
550.7 g/mol |
|
TCMBANKIN048241 |
11-Hydroxy-9-tridecenoicacid |
|
C13H24O3 |
228.328 |
C([H])([H])([H])C([H])([H])[C@]([H])(\C([H])=C([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)O[H] |
TCMBANKIN048464 |
(12α)-2α-acetoxy-5α,9α,10β-trihydroxy-3,11-cyclotax-4(20)-en-13-one |
|
C22H32O6 |
|
|
TCMBANKIN049150 |
9-deoxo-9 alpha-hydroxytaxol |
9-deoxo-9α-hydroxytaxol |
C47H53NO14 |
|
|
TCMBANKIN049381 |
taxchin a |
|
C32H46O13 |
|
CC1=C2C(C(C3(C(CC(C(C3C(C(C2(C)C)CC1OC(=O)C)O)COC(=O)C)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN049449 |
20-Epi-16'-decarbomethoxy 19,20-connoduramine |
|
C41H54N4O3 |
|
c1([H])c(c(C([H])([H])[C@@]2([H])[C@]([H])(C(=O)OC([H])([H])[H])[C@@]([H])(C([H])([H])[C@@]3([H])c(c([H])c4OC([H])([H])[H])c([H])c([C@]([H])(C([H])([H])C([H])([H])N5[C@@]6([H])[C@]7([H])C([H])([H])[C@
@]([H])(C5([H])[H])C([H])([H])[C@]6([H])C([H])([H])C([H])([H])[H])[C@@]7([H])N8[H])c48)[C@](C([H])([H])C([H])([H])[H])([H])C([H])([H])N2C([H])([H])[H])c3n9[H])c9c([H])c([H])c1[H] |
TCMBANKIN049616 |
2α,7β-diacetoxy-5α,10β,13α-trihydroxy-2(3→20)abeotaxane-9-one |
|
C24H34O8 |
|
CC1=C2C(C(=O)C3(CC(=CC(C(C2(C)C)CC1OC(=O)C)O)C(CC3OC(=O)C)O)C)O |
TCMBANKIN049780 |
Deidaclin |
|
C12H17NO6 |
271.266 |
[C@@]1([H])(C([H])([H])O[H])O[C@@]([H])(O[C@@]2(C#N)C([H])=C([H])C([H])([H])C2([H])[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])O[H] |
TCMBANKIN049931 |
Dantaxusin C |
|
|
680.7 g/mol |
|
TCMBANKIN050002 |
(-)-2alpha-Acetoxy-2',7-dideacetoxy-1-hydroxy-11(15-1)-abeo-austrospicatine |
|
C39H53NO12 |
|
C1(=C(C([H])([H])[H])[C@@]([H])(OC(C([H])([H])[H])=O)C2([H])[H])[C@]2(C(O[H])(C([H])([H])[H])C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]([H])(C(=C([H])[H])[C@@]([H])(OC(=O)C([H])([H])[C@]([H])
(c3c([H])c([H])c([H])c([H])c3[H])N(C([H])([H])[H])C([H])([H])[H])C([H])([H])[C@]4([H])O[H])[C@]4(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]1([H])OC(=O)C([H])([H])[H] |
TCMBANKIN050288 |
9α,10β-diacetoxy-5α-cinnamoyloxytaxa-4(20),11-dien-13α-ol |
|
C33H42O7 |
|
|
TCMBANKIN050383 |
2alpha-Acetoxyaustrospicatine |
2α-acetoxyaustrospicatine |
C43H57NO14 |
|
C1(=C(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C2([H])[H])C(C([H])([H])[H])(C([H])([H])[H])[C@]2([H])[C@@]([H])(OC(C([H])([H])[H])=O)[C@]([H])(C(=C([H])[H])[C@@]([H])(OC([C@]([H])(OC(=O)C([H])([
H])[H])[C@]([H])(N(C([H])([H])[H])C([H])([H])[H])c3c([H])c([H])c([H])c([H])c3[H])=O)C([H])([H])[C@]4([H])OC(=O)C([H])([H])[H])[C@]4(C([H])([H])[H])[C@@]([H])(OC(C([H])([H])[H])=O)[C@]1([H])OC(=O)C([H]
)([H])[H] |
TCMBANKIN050472 |
Dantaxusin A |
|
|
620.7 g/mol |
|
TCMBANKIN058050 |
Oil garlic; allyl monosulfide; diallyl sulfide |
Diallyl sulphide; BSPBio_003591; Spectrum2_000837; NSC 20947; Thioallyl ether; 3-(allylthio)prop-1-ene; SPBio_000793; 3,3'-thiobis(prop-1-ene); 32660_FLUKA; WLN: 1U2S2U1; Dially monosulfide; SPECTRUM1505293; Diallyl thioather; Allyl sulfide; KBio3_003027; Diallyl monosulfide; NSC20947; A35801_ALDRICH; Allyl monosulfide; AI3-18865; Spectrum3_001991; 592-88-1; Diallyl sulfide; InChI=1/C6H10S/c1-3-5-7-6-4-2/h3-4H,1-2,5-6H; 4-01-00-02097 (Beilstein Handbook Reference); 3-prop-2-enylsulfanylprop-1-ene; W204218_ALDRICH; 2-Propenyl sulphide; EINECS 209-775-1; LS-16414; ZINC01531083; 1-Propene, 3,3'-thiobis-; 3-allylsulfanylprop-1-ene; FEMA No. 2042; C08370; CCRIS 3252; SDCCGMLS-0066835.P001; AIDS-109731; BRN 1736016; Diallyl thioether; AIDS109731; 3,3-Thiobis(1-propene); 132879-26-6; NCGC00095345-01; CC-26436; BSPBio_003591; A0235; Q-100687; diallylsulfide; 3,3'-Thiobis-1-propene, 9CI; KB-49700; KBio3_003027; Diallyl monosulfide; ACMC-209mc0; Allyl monosulfide; KSC490I9L; ST51046353; (CH2=CHCH2)2S; di-2-Propenyl sulfide; 3-prop-2-enylsulfanylprop-1-ene; CJ-24086; FEMA No. 2042; C08370; CCRIS 3252; SDCCGMLS-0066835.P001; Diallyl thioether; 132879-26-6; 4-Thia-1,6-heptadiene; SCHEMBL45800; Spectrum2_000837; NSC 20947; 3,3'-thiobis(prop-1-ene); Allyl sulfide, United States Pharmacopeia (USP) Reference Standard; SPECTRUM1505293; SBB060116; SR-05000002373; NSC-20947; AC1L1XQU; AI3-18865; MFCD00008658; 592-88-1; HSDB 7333; BDBM50318452; 1-Propene, 3,3'-thiobis-; 3-allylsulfanylprop-1-ene; RP19166; 7490AF; TRA0077955; FCH1115787; UNII-60G7CF7CWZ; NCGC00095345-01; DIALLYL SULFIDE; Allyl sulphide; Diallyl sulphide; TC-020290; DTXSID6060470; paragraph signthornI(c)+/-u>>uAoAN; 1-Propene,3,3'-thiobis-; SPBio_000793; 3-Allylsulfanyl-propene; NCGC00095345-02; 1-prop-2-enylthioprop-2-ene; Prop-1-ene-3,3'-thiobis; AKOS015897442; AN-46219; 3-(Allylsulfanyl)-1-propene; MCULE-7417537491; Spectrum3_001991; InChI=1/C6H10S/c1-3-5-7-6-4-2/h3-4H,1-2,5-6H; 4-01-00-02097 (Beilstein Handbook Reference); RTC-020290; 2-Propenyl sulphide; EINECS 209-775-1; ZINC1531083; KS-00000X7D; CTK3J0495; MolPort-003-665-654; I09-0131; 3-(prop-2-en-1-ylsulfanyl)prop-1-ene; CCG-40295; DB-053358; FEMA 2042; Thioallyl ether; C-27437; WLN: 1U2S2U1; Dially monosulfide; Diallyl thioather; Allyl sulfide; 3-(Allylsulfanyl)-1-propene #; Allyl sulfide, 97%; Allyl sulfide, analytical standard; NSC20947; Allyl sulfide, >=97%, FG; STL453662; 60G7CF7CWZ; 1-Propene,3'-thiobis-; LS-16414; UBJVUCKUDDKUJF-UHFFFAOYSA-N; CHEBI:4489; ANW-33214; CHEMBL170458; C6H10S; SR-05000002373-1; CJ-05229; BRN 1736016; Oil garlic; 3,3-Thiobis(1-propene); FT-0624605 |
C6H10S |
114.21 g/mol |
C=CCSCC=C |
TCMBANKIN059467 |
deactylturraeanthin |
|
C30H48O4 |
|
CC1(C(CCC2(C1CC=C3C2CCC4(C3(CCC4C5CC(OC5O)C6C(O6)(C)C)C)C)C)O)C |
TCMBANKIN059655 |
yunnancoronarin a |
|
C20H28O2 |
300.4 g/mol |
CC1(CCCC2(C1C(CC(=C)C2C=CC3=COC=C3)O)C)C |
TCMBANKIN059701 |
taxusprine u |
|
C28H40O11 |
552.6 g/mol |
CC1=C(C(C2=C(C(CC(C2(C)C)C(C=C(C(CC1O)OC(=O)C)CO)O)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN059768 |
2'-deacetoxyaustrotaxine |
|
C39H51NO11 |
709.8 g/mol |
CC1=C2C(=O)C(C3(C(CC(C2(C)C)C(C1OC(=O)C)OC(=O)C)C(=C)C(CC3OC(=O)C)OC(=O)CC(C4=CC=CC=C4)N(C)C)C)OC(=O)C |
TCMBANKIN059772 |
19-hydroxybaccatin iii |
|
C31H38O12 |
602.6 g/mol |
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)CO)OC(=O)C |
TCMBANKIN059774 |
taxine c |
|
C33H45NO9 |
|
CC1=C2C(C(=O)C3(CC(=CC(C(C2(C)C)CC1OC(=O)C)O)C(CC3O)OC(=O)C(C(C4=CC=CC=C4)N(C)C)O)C)O |
TCMBANKIN059776 |
taxine b(ii) |
|
C28H38O10 |
|
CC1=C2C(C(=O)C3(CC(=CC(C(C2(C)C)CC1OC(=O)C)OC(=O)C)C(CC3OC(=O)C)O)C)OC(=O)C |
TCMBANKIN059777 |
taxuspine b |
|
C35H42O10 |
622.7 g/mol |
CC1=C2C(C(=O)C3(CC(=CC(C(C2(C)C)CC1OC(=O)C)OC(=O)C)C(CC3OC(=O)C)OC(=O)C=CC4=CC=CC=C4)C)O |
TCMBANKIN059791 |
taxuyunnanine |
|
C33H42O12 |
630.7 g/mol |
CC1=C2C(C(C3(C(CC(C4(C3C(C2(CC1OC(=O)C)C(C)(C)O)OC4)OC(=O)C)O)OC(=O)C)C)OC(=O)C5=CC=CC=C5)O |
TCMBANKIN059792 |
yunnanxamine |
|
C47H53NO14 |
855.9 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)O)OC(=O)C |
TCMBANKIN059794 |
taxayuntin h |
|
C30H42O13 |
610.6 g/mol |
CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN060429 |
Cyclopamine |
|
C27H41NO2 |
411.6 g/mol |
CC1CC2C(C(C3(O2)CCC4C5CC=C6CC(CCC6(C5CC4=C3C)C)O)C)NC1 |
TCMBANKIN061585 |
Ferulaldehyde |
AIDS097066; AIDS-097066; ferulaldehyde ; 382051_ALDRICH; 4-Hydroxy-3-methoxycinnamaldehyde; (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enal; 2-Propenal, 3-(4-hydroxy-3-methoxyphenyl), (E)-; 3-(4-hydroxy-3-methoxy-phenyl)prop-2-enal; 3-(4-hydroxy-3-methoxy-phenyl)acrolein; (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enal; InChI=1/C10H10O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-7,12H,1H3/b3-2; CHEBI:16547; C02666; (E)-3-(4-hydroxy-3-methoxy-phenyl)acrolein; 458-36-6; Coniferyl aldehyde; ferulaldehyde; 3-(4-hydroxy-3-methoxyphenyl)prop-2-enal; Coniferaldehyde; coniferylaldehyde; coniferaldehyde; trans-coniferyl aldehyde; coniferyl aldehyde; ferulylaldehyde; (E)-ferulaldehyde |
C10H10O3 |
178.18 |
COC1=C(C=CC(=C1)C=CC=O)O |