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 |
TCMBANKIN002534 |
2-deacetoxy-7,9-dideacetyltaxinine j |
|
C33H42O8 |
|
CC1=C2C(C(C3(C(CC(C2(C)C)CC1OC(=O)C)C(=C)C(CC3O)OC(=O)C=CC4=CC=CC=C4)C)O)OC(=O)C |
TCMBANKIN003259 |
2-debenzoyl-2-tigloyl-10-deacetylbaccatin iii |
|
C27H38O10 |
|
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C=C(C)C)(CO4)OC(=O)C)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 |
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 |
TCMBANKIN010152 |
5,10(15)-cadiene-4-ol |
|
|
218.42 |
|
TCMBANKIN011849 |
2-deacetoxytaxinine j |
|
C37H46O10 |
650.8 g/mol |
CC1=C2C(C(C3(C(CC(C2(C)C)CC1OC(=O)C)C(=C)C(CC3OC(=O)C)OC(=O)C=CC4=CC=CC=C4)C)OC(=O)C)OC(=O)C |
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 |
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 |
TCMBANKIN017673 |
taxacustin |
|
C28H40O12 |
568.6 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)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 |
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 |
TCMBANKIN026077 |
2-deacetoxy-5-decinnamoyl taxinin j |
|
C28H40O9 |
|
|
TCMBANKIN026737 |
13-acetylbrevifoliol |
|
C33H42O10 |
|
CC1=C2C(C(C3(C(CC(C(=C)C3CC2(CC1OC(=O)C)C(C)(C)O)O)OC(=O)C)C)OC(=O)C)OC(=O)C4=CC=CC=C4 |
TCMBANKIN030720 |
wallifoliol |
|
C29H34O10 |
542.6 g/mol |
CC1=C2C3(CC1O)C(C4C(C2(C(=O)OC3(C)C)O)(C(CC5C4(CO5)OC(=O)C)O)C)OC(=O)C6=CC=CC=C6 |
TCMBANKIN033131 |
n-debenzoyl-n-butanoyal-10-deacetylpaclitaxel |
|
C42H51NO13 |
|
|
TCMBANKIN034429 |
7,2'-didesacetoxy austrospicatine |
|
C37H51NO8 |
637.8 g/mol |
CC1=C2C(C(C3(CCC(C(=C)C3CC(C2(C)C)CC1OC(=O)C)OC(=O)CC(C4=CC=CC=C4)N(C)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN037133 |
13-Acetoxylbrevifoliol |
|
C33H42O10 |
|
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(O[H])C([H])([H])[C@]([H])(C(=C([H])[H])[C@@]([H])(O[H])C([H])([H])[C@]3([H])OC(=O)c4c([H])c([H])c
([H])c([H])c4[H])[C@]3(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]1([H])OC(=O)C([H])([H])[H] |
TCMBANKIN037173 |
Triacetyl-5-decinnamoyltaxicin I |
|
C26H36O9 |
492.6 g/mol |
[C@@]12(C([H])([H])[H])[C@]([H])([C@]([H])(OC(=O)C([H])([H])[H])[C@@]3(O[H])C(C([H])([H])[H])(C([H])([H])[H])C(=C(C([H])([H])[H])C(=O)C3([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])(O[H])C([H])([H])C2([H])[H] |
TCMBANKIN038431 |
didrovaltratum |
|
C22H32O8 |
424.5 g/mol |
CC(C)CC(=O)OCC1=COC(C2C1CC(C23CO3)OC(=O)C)OC(=O)CC(C)C |
TCMBANKIN039432 |
taxawallin a |
|
C37H46O11 |
|
CC1=C2C(C(C3(C(CC(C(=C)C3CC(C2(C)C)(CC1OC(=O)C)O)OC(=O)C=CC4=CC=CC=C4)OC(=O)C)C)OC(=O)C)OC(=O)C |
TCMBANKIN039667 |
Taxawallin D |
|
C33H42O10 |
|
[C@@]1([H])(OC(=O)C([H])([H])[H])[C@]([H])(OC(=O)c2c([H])c([H])c([H])c([H])c2[H])[C@@]3(C([H])([H])[H])[C@@]([H])(C(=C([H])[H])[C@]([H])(O[H])C([H])([H])[C@]3([H])OC(=O)C([H])([H])[H])C([H])([H])[C@@]
4(C(C([H])([H])[H])(O[H])C([H])([H])[H])C1=C(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C4([H])[H] |
TCMBANKIN039960 |
Taxawallin H |
|
C26H38O9 |
|
[C@@]1([H])(OC(=O)C([H])([H])[H])[C@]([H])(OC(=O)C([H])([H])[H])[C@@]2(C([H])([H])[H])[C@@]([H])(C(=C([H])[H])[C@@]([H])(O[H])C([H])([H])[C@]2([H])OC(=O)C([H])([H])[H])C([H])([H])[C@@]3(C(C([H])([H])[
H])(O[H])C([H])([H])[H])C1=C(C([H])([H])[H])[C@@]([H])(O[H])C3([H])[H] |
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 |
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] |
TCMBANKIN042187 |
2'-Deacetoxyaustrotaxine |
|
|
709.8 g/mol |
|
TCMBANKIN042378 |
(5α,8α)-2-Oxo-1(10),3,7(11)-guaiatrien-12,8-olide |
|
|
|
|
TCMBANKIN042781 |
5alpha,9alpha-Dihydroxymatrine |
5α,9α-dihydroxymatrine; 5alpha,9alpha-dihydroxymatrine |
C15H24N2O3 |
280.41 |
C1CC2C3CC(CN4C3C(CCC4)(CN2C(=O)C1)O)O |
TCMBANKIN043556 |
Taxawallin F |
|
C26H38O9 |
|
[C@@]1([H])(O[H])[C@]([H])(OC(=O)C([H])([H])[H])[C@@]2(C([H])([H])[H])[C@@]([H])(C(=C([H])[H])[C@@]([H])(O[H])C([H])([H])[C@]2([H])OC(=O)C([H])([H])[H])C([H])([H])[C@@]3(C(C([H])([H])[H])(O[H])C([H])(
[H])[H])C1=C(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C3([H])[H] |
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 |
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 |
TCMBANKIN046291 |
Taxawallin G |
|
C26H38O9 |
|
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(O[H])C([H])([H])[C@]([H])(C(=C([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C([H])([H])[C@@]3([H])O[H]
)[C@]3(C([H])([H])[H])[C@@]([H])(O[H])[C@]1([H])OC(=O)C([H])([H])[H] |
TCMBANKIN046811 |
2'beta-deacetylaustrospicatine |
|
|
|
|
TCMBANKIN047179 |
19-debenzoyl-19-acetyltaxinine m |
|
C30H40O14 |
624.6 g/mol |
CC(=O)OCC12C(CC(C(=C)C1C(C3CC(=O)C4(C(C3(CO4)C)(C(C2OC(=O)C)OC(=O)C)O)C)OC(=O)C)O)OC(=O)C |
TCMBANKIN047271 |
2-Deacetyl-10-acetyltaxine B |
|
|
|
|
TCMBANKIN047807 |
13,14-epoxide 9,11,12-hydroxytriptolide |
|
C20H26O7 |
|
CC(C)C12C(C(C3(C4(CCC5=C(C4CC6C3(C1O2)O6)COC5=O)C)O)O)O |
TCMBANKIN049108 |
Taxacustin XII |
|
C28H40O12 |
|
C1(C([H])([H])[H])=C2[C@@](C(C([H])([H])[H])(O[H])C([H])([H])[H])([C@@]([H])(OC(=O)C([H])([H])[H])[C@]([H])([C@@](C([H])([H])O3)(OC(C([H])([H])[H])=O)[C@@]3([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@@]2([H])O[H])C([H])([H])[C@]1([H])O[H] |
TCMBANKIN050317 |
2α-acetoxy-4β-hydroxy-6α-angeloyloxy-10β-benzoyloxy-dauc-8-ene |
|
C29H38O7 |
|
|
TCMBANKIN059047 |
19-debenzoyl-19-acetyltaxinine m |
19-debenzoyl-19-acetyltaxinine |
C30H40O14 |
624.6 g/mol |
CC(=O)OCC12C(CC(C(=C)C1C(C3CC(=O)C4(C(C3(CO4)C)(C(C2OC(=O)C)OC(=O)C)O)C)OC(=O)C)O)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 |
TCMBANKIN059756 |
ecinnamoyl-1-hydroxy-taxchinin j |
|
C30H42O12 |
|
CC1=C(CC2C(C3C(=C)C(CC(C3(C(C(C1(C2(C)C)O)OC(=O)C)OC(=O)C)C)OC(=O)C)O)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 |
TCMBANKIN059771 |
14beta-hudroxy-10-deacetylbaccatin iii |
|
C29H36O11 |
|
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(C(C1O)O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O |
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 |
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 |
TCMBANKIN059787 |
1beta,7beta-dihydroxy-4beta,20-epoxy-2alpha,5alpha,9alpha,10beta,13alpha-pentaacetoxytax-11-ene |
|
C30H42O13 |
|
CC1=C2C(C(C3(C(CC(C4(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C)CO4)OC(=O)C)O)C)OC(=O)C)OC(=O)C |
TCMBANKIN059793 |
taxacustin |
|
C28H40O12 |
568.6 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)O |
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 |
TCMBANKIN059803 |
7-debenzoyloxy-10-deacetyl-brevifoliol |
|
C22H34O6 |
|
CC1=C2C(C(C3(CCC(C(=C)C3CC2(CC1O)C(C)(C)O)O)C)OC(=O)C)O |
TCMBANKIN059804 |
5alpha-O-(3'-Methylamino-3'-phenylpropionyl)nicotaxine |
|
|
716.9 |
CC1=C2C(C(C3(CCC(C4(C3C(C(C2(C)C)CC1=O)OC(=O)C)CO4)OC(=O)CC(C5=CC=CC=C5)NC)C)OC(=O)C6=CN=CC=C6)OC(=O)C |
TCMBANKIN059817 |
10,15-epoxy-11(15->1)-abeo-10-deacelybaccatin iii |
|
|
|
CC1=C2C3C(=O)C4(C(CC5C(C4C(C2(CC1O)C(O3)(C)C)OC(=O)C6=CC=CC=C6)(CO5)OC(=O)C)O)C |
TCMBANKIN060315 |
isoepoxypteryxin |
|
C21H22O8 |
402.4 g/mol |
CC1C(O1)(C)C(=O)OC2C(C3=C(C=CC4=C3OC(=O)C=C4)OC2(C)C)OC(=O)C |