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 |
TCMBANKIN000299 |
13-epi-10-deacetylbaccatin 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 |
TCMBANKIN002079 |
9-acetoxytaxine b |
|
C35H47NO9 |
|
|
TCMBANKIN003108 |
5α-ergost-7,22-dien-3β-ol |
|
|
|
|
TCMBANKIN003123 |
7,9,10-trideacetyl-abeo-baccatin vi |
|
C31H42O11 |
590.7 g/mol |
CC1C(CC2(C1C(C(C3(C(CC4C(C3C2OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O)O)C(C)(C)O)OC(=O)C |
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 |
TCMBANKIN004169 |
cephalotaxinamide |
|
C18H19NO5 |
|
COC1=CC23CCC(=O)N2CCC4=CC5=C(C=C4C3C1O)OCO5 |
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 |
TCMBANKIN005474 |
7-o-acetyltaxine a |
|
C37H49NO11 |
683.8 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(C(C4=CC=CC=C4)N(C)C)O)C)O |
TCMBANKIN005605 |
9-deacetyl-9-benzoyl-10-debenzoyltaxchinin a |
|
C31H40O10 |
572.6 g/mol |
CC1=C2C(C(C3(C(CC(C(=C)C3C(C2(CC1O)C(C)(C)O)OC(=O)C)O)OC(=O)C)C)OC(=O)C4=CC=CC=C4)O |
TCMBANKIN007505 |
taxa-4(20),11-diene-10beta-methoxy-2alpha,5alpha,diacetoxy-14beta-(alpha-methyl)butyrate |
|
C30H46O7 |
|
|
TCMBANKIN009447 |
5-cinnamoyl-10-aceyltaxicin ii |
|
C31H38O7 |
|
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)O)O |
TCMBANKIN009470 |
10-acetoxytaxine b |
|
C35H47NO9 |
|
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1=O)O)OC(=O)C)OC(=O)CC(C4=CC=CC=C4)N(C)C)C)O)OC(=O)C |
TCMBANKIN009644 |
2alpha-(alpha-methylbutyrul)-oxy-5alpha,7belta,10belta-triacetory-4(20),11-taxadiene |
|
C31H46O8 |
|
|
TCMBANKIN009695 |
12-o-cinnamoyl-20-o-tigloyl sarcostin |
|
C35H46O8 |
|
CC=C(C)C(=O)OC(C)C1(CCC2(C1(C(CC3C2(CC=C4C3(CCC(C4)O)C)O)OC(=O)C=CC5=CC=CC=C5)C)O)O |
TCMBANKIN010885 |
taxagifine iii |
|
C24H34O11 |
498.5 g/mol |
CC(=O)OC1CC2C(CO2)(C3C1(C(=O)C(C4(C5(COC4(C(CC5C3O)O)C)C)O)O)C)OC(=O)C |
TCMBANKIN011259 |
deaminoacyltaxine a |
|
C24H34O8 |
450.5 g/mol |
CC1=C2C(C(=O)C3(CC(=CC(C(C2(C)C)CC1OC(=O)C)OC(=O)C)C(CC3O)O)C)O |
TCMBANKIN012094 |
7-epi-9,10-deacetylbaccatin vi |
|
C31H40O11 |
|
|
TCMBANKIN012162 |
5-cinnamoyl-9-o-acetylphototaxicin i |
|
C31H38O8 |
|
CC1C(=O)CC2(C(C34C1(C2(C)C)C(C(C3(CCC(C4=C)OC(=O)C=CC5=CC=CC=C5)C)OC(=O)C)O)O)O |
TCMBANKIN012346 |
diacetyldecinnamoyltaxicin i |
|
C24H34O8 |
|
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1=O)O)OC(=O)C)O)C)O)OC(=O)C |
TCMBANKIN012968 |
2α-acetoxy-2'β-deacetyl-1-hydroxyaustrospi-catine |
|
C41H55NO14 |
|
|
TCMBANKIN013995 |
taxa-4(20),11-diene-5alpha-hydroxy-1beta,7beta,9alpha,10beta-tetraacetate |
taxa-4(20),11-diene-5α-hydroxy-1β,7β,9α,10β-tetraacetate |
C28H40O9 |
|
CC1=C2C(C(C3(C(CC(C(=C)C3CC(C2(C)C)(CC1)OC(=O)C)O)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN014259 |
10-(β-hydroxybutyryl)-10-deacetylcophaloman-nine |
|
C47H57NO15 |
|
|
TCMBANKIN014777 |
1β-hydroxy-7β-deacetyoxy-7α-hydroxybaccatini |
|
C30H42O13 |
|
|
TCMBANKIN015613 |
rhoeadine |
|
C21H21NO6 |
383.39 |
CN1CCC2=CC3=C(C=C2C4C1C5=C(C(O4)OC)C6=C(C=C5)OCO6)OCO3 |
TCMBANKIN015678 |
o-cinnamoyltaxicin i triacetate |
|
C35H42O10 |
622.7 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1=O)O)OC(=O)C)OC(=O)C=CC4=CC=CC=C4)C)OC(=O)C)OC(=O)C |
TCMBANKIN015955 |
n-methyltaxol c |
|
C47H59NO14 |
862 g/mol |
CCCCCC(=O)N(C)C(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 |
TCMBANKIN016453 |
cephalomannine |
|
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 |
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 |
TCMBANKIN016691 |
2-debenzoyl-2-tigloyltaxol |
|
C45H53NO14 |
|
CC=C(C)C(=O)OC1C2C(C(CC3C2(CO3)OC(=O)C)O)(C(=O)C(C4=C(C(CC1(C4(C)C)O)OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)C)OC(=O)C)C |
TCMBANKIN017100 |
baccatin ii |
|
C31H38O11 |
|
|
TCMBANKIN017924 |
9α-hydroxy-14β-(2-methylbutyryl)-oxy-2α,5α,10β-tri acetoxytaxa-4(20),11-diene |
9alpha-hydroxy-14beta-(2-methylbutyryl)oxy-2alpha,5alpha,10beta-triacetoxytaxa-4(20),11-diene |
C31H46O9 |
|
|
TCMBANKIN018094 |
deacetyleupaserrin |
|
C20H26O6 |
362.4 g/mol |
CC=C(CO)C(=O)OC1CC(=CC(CC(=CC2C1C(=C)C(=O)O2)C)O)C |
TCMBANKIN019029 |
2-deacetyltaxachitriene a |
|
C30H42O12 |
594.6 g/mol |
CC1=C2C(C(=C(C(CC(C(=CC(C(C2(C)C)CC1OC(=O)C)O)COC(=O)C)O)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN019992 |
baccatin v |
|
C31H38O11 |
586.6 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)OC(=O)C |
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 |
TCMBANKIN021383 |
4-deacetyltaxagifine iii |
|
C22H32O10 |
456.5 g/mol |
CC(=O)OC1CC2C(CO2)(C3C1(C(=O)C(C4(C5(COC4(C(CC5C3O)O)C)C)O)O)C)O |
TCMBANKIN021710 |
taxagifine |
|
C37H44O13 |
696.7 g/mol |
CC(=O)OC1CC(C(=C)C2C1(C(C(C3(C4(COC3(C(=O)CC4C2OC(=O)C)C)C)O)OC(=O)C)OC(=O)C)C)OC(=O)C=CC5=CC=CC=C5 |
TCMBANKIN022307 |
o-d-xylosylvitexin |
|
C26H28O14 |
|
C1C(C(C(C(O1)OC2C(C(C(OC2C3=C(C=C(C4=C3OC(=CC4=O)C5=CC=C(C=C5)O)O)O)CO)O)O)O)O)O |
TCMBANKIN022616 |
7-hydroxycadalenal |
|
C15H16O2 |
228.29 g/mol |
CC1=C2C=C(C(=CC2=C(C=C1)C(C)C)C=O)O |
TCMBANKIN022936 |
7β,9α-diacetoxy-5α,13α,14β-trihydroxy-10-oxo-taxa-4(20),11-diene |
7beta,9alpha-diacetoxy-5alpha,13alpha,14beta-trihydroxy-10-oxotaxa-4(20),11-diene |
C24H34O8 |
|
|
TCMBANKIN023439 |
(5aR,8aS,9R)-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-isobenzofurano[5,6-f][1,3]benzodioxol-8-one |
|
|
398.44 |
|
TCMBANKIN023467 |
5-cis-cyclopentadecen-1-one |
|
C15H26O |
|
C1CCCCC=CCCCC(=O)CCCC1 |
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 |
TCMBANKIN024113 |
tetrahydroxytaxadiene |
|
C20H32O4 |
|
CC1=C2C(C(C3(CCC(C(=C)C3CC(C2(C)C)CC1O)O)C)O)O |
TCMBANKIN024943 |
baccatin vi |
|
C37H46O14 |
714.8 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)OC(=O)C |
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 |
|
|
TCMBANKIN026958 |
9alpha,10beta-diacetoxy-5alpha,13alpha-dihydroxy-4(20),11-taxadiene |
9α,10β-diacetoxy-5α,13α-dihydroxy-4(20),11-taxadiene |
C24H36O6 |
|
CC1=C2C(C(C3(CCC(C(=C)C3CC(C2(C)C)CC1O)O)C)OC(=O)C)OC(=O)C |
TCMBANKIN028127 |
2α-(α-methylbutyryl)-oxy-5α,7β,9α,10β-tetra-acetoxy-4(20),11-taxadiene |
|
C33H48O10 |
|
|
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 |
TCMBANKIN029308 |
rhodoxanthin |
|
C40H50O2 |
562.8 g/mol |
CC1=CC(=O)CC(C1=CC=C(C)C=CC=C(C)C=CC=CC(=CC=CC(=CC=C2C(=CC(=O)CC2(C)C)C)C)C)(C)C |
TCMBANKIN029368 |
teixidol |
|
C28H40O10 |
536.6 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C2(CC1OC(=O)C)C(C)(C)O)OC(=O)C)O)C)OC(=O)C)OC(=O)C |
TCMBANKIN030062 |
taxinine a |
|
C26H36O8 |
476.6 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)CC1=O)OC(=O)C)O)C)OC(=O)C)OC(=O)C |
TCMBANKIN030132 |
diacetoxytetrahydroxytaxadiene |
|
C24H36O8 |
|
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1O)O)OC(=O)C)O)C)OC(=O)C)O |
TCMBANKIN030163 |
n-debenzoyl-n-cinnamoyltaxol |
|
C49H53NO14 |
|
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C=CC6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C |
TCMBANKIN030842 |
baccatin i |
|
C32H44O13 |
636.7 g/mol |
CC1=C2C(C(C3(C(CC(C4(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 |
TCMBANKIN031033 |
(?)-2α-acetoxy-2',7-dideacetoxy-1-hydroxy-11(15→1)-abeo-austrospicatine |
|
C39H53NO11 |
|
|
TCMBANKIN031340 |
o-cinnamoyltaxicin i |
|
C29H36O7 |
496.6 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1=O)O)O)OC(=O)C=CC4=CC=CC=C4)C)O)O |
TCMBANKIN032082 |
taxa-4(20),11-diene-10β-methoxy-2α,5α-diacet-oxy-14β-(α-methyl)butyrate |
|
C30H46O7 |
|
|
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 |
TCMBANKIN034068 |
5-cinnamoylphototaxicin ii |
|
C29H36O6 |
|
CC1C(=O)CC2C(C34C1(C2(C)C)C(C(C3(CCC(C4=C)OC(=O)C=CC5=CC=CC=C5)C)O)O)O |
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 |
TCMBANKIN036765 |
5alpha-decinnamoyltaxagifine |
5α-decinnamoyltaxagifine |
C27H36O12 |
552.6 g/mol |
CC(=O)OC1CC(C(=C)C2C1C(C(C3(C4(COC3(C(=O)CC4C2OC(=O)C)C)C)O)OC(=O)C)OC(=O)C)O |
TCMBANKIN037241 |
2'β-Deacetoxyaustrospicatine |
|
|
|
|
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] |
TCMBANKIN037548 |
2-(decan-9-one)-n-methyl-4-quinolone |
|
C20H27NO2 |
|
CC(=O)CCCCCCCCC1=CC(=O)C2=CC=CC=C2N1C |
TCMBANKIN037846 |
1,3,7,8-Tetrahydroxyxanthone-1-O-beta-D-glucopyranoside |
1,3,7,8-tetrahydroxyxanthone-1-o-β-d-gluco-pyranoside |
C19H18O11 |
422.34 |
c1(O[H])c(O[H])c(C(=O)c(c(O[C@@]([H])(O[C@]([H])(C([H])([H])O[H])[C@@]([H])(O[H])[C@@]2([H])O[H])[C@]2([H])O[H])c([H])c(O[H])c3[H])c3O4)c4c([H])c1[H] |
TCMBANKIN038514 |
7-(beta-xylosyl)-10-deacetyltaxol d |
7-(β-xylosyl)-10-deacetyltaxol d |
C47H59NO17 |
|
CCCC(=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)O)C)OC(=O)C7=CC=CC=C7)O)O |
TCMBANKIN038559 |
omega-cis-hydroxy-delta2-decenoic acid |
|
C10H18O3 |
186.248 |
CC(CCCCCC=CC(=O)O)O |
TCMBANKIN039233 |
7-(beta-Xylosyl)taxol |
7-(β-xylosyl)taxol |
C52H59NO18 |
|
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])OC(=O)C([H])([H])[H] |
TCMBANKIN039938 |
9(betaH)-9-Dihydro-19-acetoxy-10-deacetylbaccatin III |
9(βh)-9-dihydro-19-acetoxy-10-deacetyl-baccatin iii |
C31H40O12 |
|
C(OC([H])([H])[C@@]12[C@]([H])([C@]([H])(OC(=O)c3c([H])c([H])c([H])c([H])c3[H])[C@@]4(O[H])C(C([H])([H])[H])(C([H])([H])[H])C(=C(C([H])([H])[H])[C@@]([H])(O[H])C4([H])[H])[C@@]([H])(O[H])[C@@]1([H])O[
H])[C@@]5(OC(=O)C([H])([H])[H])[C@]([H])(OC5([H])[H])C([H])([H])[C@]2([H])O[H])(C([H])([H])[H])=O |
TCMBANKIN039974 |
Baccatin III |
|
|
586.6 g/mol |
|
TCMBANKIN040301 |
10-Deactyltaxuyunnanine A |
|
C44H55NO13 |
|
[C@@]12(C([H])([H])[H])[C@]([H])([C@]([H])(OC(=O)c3c([H])c([H])c([H])c([H])c3[H])[C@@]4(O[H])C(C([H])([H])[H])(C([H])([H])[H])C(=C(C([H])([H])[H])[C@@]([H])(OC([C@]([H])(O[H])[C@@]([H])(c5c([H])c([H])
c([H])c([H])c5[H])N([H])C(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])=O)C4([H])[H])[C@@]([H])(O[H])C1=O)[C@@]6(OC(=O)C([H])([H])[H])[C@]([H])(OC6([H])[H])C([H])([H])[C@]2([H])O[H] |
TCMBANKIN040863 |
tellimagrandin I |
tellimagrandinI; tellimagrandin i; cornus-tannin 3; tellimagrandin i ; AC1Q59JF |
C12H14ClNO4 |
271.7 |
C1C2C(C(C(C(O2)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O1)O)O)O)O)O)O |
TCMBANKIN040870 |
7-xylosyl-10-deacetylbaccatin |
|
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 |
TCMBANKIN040933 |
7-(beta-Xylosyl)cephalomannine |
7-(β-xylosyl)cephalomannine; 7-(beta-xylosyl)cephalomannine |
C51H63NO17 |
962.15 |
[C@@]1([H])(OC(=O)C([H])([H])[H])C(=C(C([H])([H])[H])[C@]([H])(OC(=C([H])[H])[C@]([H])(O[H])[C@@]([H])(N([H])C(=O)\C(=C([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(c4c([H])c([H])c([H])c([H])c4[H])=O)[C@]([H])([C@@]5(OC(=O)C([H])([H])[H])[C@]([H])(OC5([H])[H])C([H])([H])[C@@]6(O[C@]7([H])OC([H])([H])[C@]([H]
)(O[H])[C@]([H])(O[H])[C@@]7([H])O[H])[H])[C@]6(C([H])([H])[H])C1=O |
TCMBANKIN041057 |
10-(beta-Hydroxybutyryl)-10-beacetyltaxol |
|
C49H55NO15 |
|
C1(=C(C([H])([H])[H])[C@@]([H])(OC([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])=O)C4([H])[H])C(C([H])([H])[H])(C([H])([H])[H])[C@]4(O[H])[C@@]([
H])(OC(c5c([H])c([H])c([H])c([H])c5[H])=O)[C@@]6([H])[C@@](C([H])([H])[H])([C@@]([H])(O[H])C([H])([H])[C@@]([H])(OC7([H])[H])[C@]67OC(=O)C([H])([H])[H])C(=O)[C@]1([H])OC(C([H])([H])[C@]([H])(O[H])C([H
])([H])[H])=O |
TCMBANKIN041124 |
4α,7β-Diacetoxy-2α,9α-dibenzoyloxy-5β,20-epoxy-10β,13α,15-trihydroxy-11(15→1)-abeo-taxene |
|
|
|
|
TCMBANKIN041513 |
10-(β-hydroxybutyryl)-10-deacetyltaxol |
|
C49H55NO15 |
|
|
TCMBANKIN041524 |
10-(beta-hydroxybutyryl)-10-deacetylbaccatin i |
10-(β-hydroxybutyryl)-10-deacetylbaccatin i; 5beta,20-Epoxy-9-oxotax-11-en-1,2alpha,4,7beta,10beta,13alpha-hexol 2-benzoate 4-acetate 10-(3-hydroxybutyrate) |
C33H42O12 |
630.7 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)O)C)OC(=O)CC(C)O |
TCMBANKIN042187 |
2'-Deacetoxyaustrotaxine |
|
|
709.8 g/mol |
|
TCMBANKIN042627 |
2alpha-(alpha-methylbutyrul)-oxy-5alpha,7belta,9alpha,10belta-tetraacetoxy-4(20),11-taxadiene |
|
|
|
|
TCMBANKIN042845 |
Taxagifin |
|
|
696.7 g/mol |
|
TCMBANKIN043415 |
3,5-Diacetyltambulin |
|
|
428.4 g/mol |
|
TCMBANKIN043453 |
2-Deacetoxyl-9-acetoxytaxine B |
|
C33H45NO7 |
|
[C@@]12(C([H])([H])[H])[C@]([H])([C@]([H])(O[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])([H])[C@@]([H])(N(C([H])([H])[H])C([H])([H])[H])c4c([H])c([H])c([H])c([H])c4[H])C([H])([H])C2([H])[H] |
TCMBANKIN043490 |
decinnamoyl-1-hydroxy-taxinine j |
|
C30H42O12 |
594.6 g/mol |
CC1=C2C(C(C3(C(CC(C(=C)C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C)O)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN043492 |
14beta-hydroxytaxusin |
14β-hydroxytaxusin |
C28H40O9 |
520.6 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3CC(C2(C)C)C(C1OC(=O)C)O)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN043652 |
2-O-Acetyl-5-O-cinnamoyltaxicin I |
|
|
|
|
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 |
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 |
TCMBANKIN044424 |
2-deacetyl-9-acetoxytaxine b |
|
C33H45NO7 |
|
|
TCMBANKIN044682 |
2alpha-Acetoxy-2',7-dideacetoxy austrospicatine |
2α-acetoxy-2',7-dideacetoxy austrospicatine |
C39H53NO10 |
|
C1(=C(C([H])([H])[H])[C@@]([H])(OC(C([H])([H])[H])=O)C2([H])[H])C(C([H])([H])[H])(C([H])([H])[H])[C@]2([H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]([H])(C(=C([H])[H])[C@@]([H])(OC(C([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])C4([H])[H])[C@]4(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]1([H])OC(=O)C([H])([H])[H] |
TCMBANKIN045154 |
taxiresinol |
|
C19H22O6 |
346.4 g/mol |
COC1=C(C=CC(=C1)CC2COC(C2CO)C3=CC(=C(C=C3)O)O)O |
TCMBANKIN045394 |
13-Deoxo-13α-acetyloxy-1-deoxynortaxine B |
|
|
|
|
TCMBANKIN045629 |
(+)-2alpha-acetoxy-2',7-dideacetoxy-1-hydroxy-austrospicatine |
(+)-2α-acetoxy-2',7-dideacetoxy-1-hydroxy-austrospicatine |
C39H53NO11 |
711.8 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C)OC(=O)CC(C4=CC=CC=C4)N(C)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN045856 |
2alpha-acetoxy-2'beta-deacetylaustrospicatine |
2α-acetoxy-2'β-deacetylaustrospicatine |
C41H55NO13 |
|
|
TCMBANKIN046035 |
n-debenzoyl-n-propanoyl-10-deacetyl paclitaxel |
n-debenzoyl-n-propanoyl-10-deacetylpaclitaxel |
C41H49NO13 |
|
CCC(=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)O)C)OC(=O)C6=CC=CC=C6)O)O |
TCMBANKIN046412 |
10-(beta-Hydroxybutyryl)-10-beacetylcophalomannine |
|
C47H57NO15 |
|
C1(=C(C([H])([H])[H])[C@@]([H])(OC([C@]([H])(O[H])[C@]([H])(N([H])C(=O)\C(\C([H])([H])[H])=C([H])\C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])=O)C3([H])[H])C(C([H])([H])[H])(C([H])([H])[H])[C@]3(O[
H])[C@@]([H])(OC(c4c([H])c([H])c([H])c([H])c4[H])=O)[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(C([H])([H])[C@]([H])
(O[H])C([H])([H])[H])=O |
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] |
TCMBANKIN046754 |
2-Deacetyl-2alpha-benzoyl-5,13-diacetyltaxchinin A |
2-deacetyl-2α-benzoyl-5,13-diacetyltaxchinin a |
C42H48O13 |
|
C1(=C(C([H])([H])[H])[C@]([H])(OC(=O)C([H])([H])[H])C2([H])[H])[C@]2(C(C([H])([H])[H])(O[H])C([H])([H])[H])[C@@]([H])(OC(=O)c3c([H])c([H])c([H])c([H])c3[H])[C@]([H])(C(=C([H])[H])[C@@]([H])(OC(=O)C([H
])([H])[H])C([H])([H])[C@]4([H])OC(=O)C([H])([H])[H])[C@]4(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]1([H])OC(=O)c5c([H])c([H])c([H])c([H])c5[H] |
TCMBANKIN047477 |
2'-deacetylaustrospicatine |
|
C39H53NO11 |
|
|
TCMBANKIN047577 |
13-Deoxo-3 alpha-acetyloxytaxine B |
13-deoxo-3α-acetyloxytaxine b |
C35H49NO9 |
|
[C@@]12(C([H])([H])[H])[C@]([H])([C@]([H])(O[H])[C@@]3(O[H])C(C([H])([H])[H])(C([H])([H])[H])C(=C(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C3([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]1([H])O[
H])C(=C([H])[H])[C@@]([H])(OC(=O)C([H])([H])[C@]([H])(c4c([H])c([H])c([H])c([H])c4[H])N(C([H])([H])[H])C([H])([H])[H])C([H])([H])C2([H])[H] |
TCMBANKIN048333 |
13-Deoxo-13 alpha-acetyloxy-1-deoxytaxine B |
13-deoxo-13α-acetyloxy-1-deoxytaxine b |
C35H49NO8 |
|
[C@@]12(C([H])([H])[H])[C@]([H])([C@]([H])(O[H])[C@]3([H])C(C([H])([H])[H])(C([H])([H])[H])C(=C(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C3([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]1([H])O[H]
)C(=C([H])[H])[C@@]([H])(OC(=O)C([H])([H])[C@]([H])(c4c([H])c([H])c([H])c([H])c4[H])N(C([H])([H])[H])C([H])([H])[H])C([H])([H])C2([H])[H] |
TCMBANKIN048387 |
alpha-Methyl-n-butyrylshijonin |
|
C20H22O6 |
358.385 |
c1([H])c(O[H])c(C(=O)C([H])=C([C@](OC(=O)[C@@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])[H])([H])\C([H])=C(/C([H])([H])[H])\C([H])([H])[H])C2=O)c2c(O[H])c1[H] |
TCMBANKIN048909 |
7-(beta-xylosyl)-10-deacetyltaxol c |
7-(β-xylosyl)-10-deacetyltaxol c |
C49H63NO17 |
|
|
TCMBANKIN049005 |
13-Acetyl-13-decinnamoyltaxchinin B |
13-acetyl-13-decinnamoyl-taxchinin b |
|
714.8 g/mol |
|
TCMBANKIN049150 |
9-deoxo-9 alpha-hydroxytaxol |
9-deoxo-9α-hydroxytaxol |
C47H53NO14 |
|
|
TCMBANKIN049687 |
5-cinnamoyl-9,10-diacetyltaxicin i |
|
C33H40O9 |
580.7 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1=O)O)O)OC(=O)C=CC4=CC=CC=C4)C)OC(=O)C)OC(=O)C |
TCMBANKIN049714 |
n-debenzoyl-n-butanoyl-10-deacetylpaclitaxel |
|
C42H51NO13 |
|
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)O)C)OC(=O)C6=CC=CC=C6)O)O |
TCMBANKIN049844 |
taxine a |
|
C35H47NO10 |
641.7 g/mol |
CC1=C2C(C(=O)C3(CC(=CC(C(C2(C)C)CC1OC(=O)C)OC(=O)C)C(CC3O)OC(=O)C(C(C4=CC=CC=C4)N(C)C)O)C)O |
TCMBANKIN050036 |
7-(beta-xylosyl)taxol c |
7-(β-xylosyl)taxol c |
C49H61NO18 |
952 g/mol |
CCCC(=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 |
TCMBANKIN050387 |
5-cinnamoyl-9,10-diaceyltaxicin i |
|
C33H40O9 |
|
|
TCMBANKIN050473 |
2alpha-Benzoyloxy-5alpha-cinnamoyloxy-1beta,13alpha-dihydroxy-4(20),11-taxadiene |
|
C40H46O10 |
|
[C@@]12(C([H])([H])[H])[C@]([H])([C@]([H])(OC(c3c([H])c([H])c([H])c([H])c3[H])=O)[C@@]4(O[H])C(C([H])([H])[H])(C([H])([H])[H])C(=C(C([H])([H])[H])[C@@]([H])(O[H])C4([H])[H])[C@@]([H])(OC(=O)C([H])([H]
)[H])[C@]1([H])OC(=O)C([H])([H])[H])C(=C([H])[H])[C@@]([H])(OC(\C([H])=C([H])/c5c([H])c([H])c([H])c([H])c5[H])=O)C([H])([H])C2([H])[H] |
TCMBANKIN058921 |
3,3'-diacetyl-4,4'-dimethoxy-2,2',6,6'-tetrahydroxy diphenyl methane |
didemethylpseudoaspidin aa |
C19H20O8 |
376.4 g/mol |
CC(=O)C1=C(C=C(C(=C1O)CC2=C(C(=C(C=C2O)OC)C(=O)C)O)O)OC |
TCMBANKIN059017 |
taxagifin iii |
taxagifine iii |
C24H34O11 |
498.5 g/mol |
CC(=O)OC1CC2C(CO2)(C3C1(C(=O)C(C4(C5(COC4(C(CC5C3O)O)C)C)O)O)C)OC(=O)C |
TCMBANKIN059370 |
10-deacetyltaxol b |
10-deactyltaxol b |
C43H51NO13 |
789.9 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)O)C)OC(=O)C6=CC=CC=C6)O)O |
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 |
TCMBANKIN059775 |
2-deacetyltaxine b |
|
C26H36O9 |
|
CC1=C2C(C(=O)C3(CC(=CC(C(C2(C)C)CC1OC(=O)C)O)C(CC3OC(=O)C)O)C)OC(=O)C |
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 |
TCMBANKIN059781 |
10-debenzoyl-2α-acetoxy-brevifoliol |
|
C26H38O10 |
|
CC1=C2C(C(C3(C(CC(C(=C)C3C(C2(CC1O)C(C)(C)O)OC(=O)C)O)OC(=O)C)C)OC(=O)C)O |
TCMBANKIN059782 |
2alpha-acetoxylbrervifoliol |
|
C33H42O11 |
614.7 g/mol |
CC1=C2C(C(C3(C(CC(C(=C)C3C(C2(CC1O)C(C)(C)O)OC(=O)C)O)OC(=O)C)C)OC(=O)C)OC(=O)C4=CC=CC=C4 |
TCMBANKIN059798 |
taxine b |
|
C33H45NO8 |
583.7 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1=O)O)O)OC(=O)CC(C4=CC=CC=C4)N(C)C)C)O)OC(=O)C |
TCMBANKIN059799 |
triacetyl-5-decinnamoyltaxicin i |
|
C26H36O9 |
492.6 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1=O)O)OC(=O)C)O)C)OC(=O)C)OC(=O)C |
TCMBANKIN060602 |
Dihydro-β-agarofuran |
|
C15H26O |
222.37 |
CC1CCCC2(C13CC(CC2)C(O3)(C)C)C |
TCMBANKIN060644 |
2alpha,5alpha,10beta-triacetoxy-14beta-(2-methyl)butyryloxytaxa-4(20),11-diene |
|
C31H46O8 |
|
CCC(C)C(=O)OC1CC(=C2C(CC3(CCC(C(=C)C3C(C1C2(C)C)OC(=O)C)OC(=O)C)C)OC(=O)C)C |
TCMBANKIN060886 |
1-methyl-2-[(z)-7-tridecenyl]-4(1h)-quinolone |
|
C23H33NO |
339.5 g/mol |
CCCCCC=CCCCCCCC1=CC(=O)C2=CC=CC=C2N1C |