| Compound-ID | 9501 |
| Common Name | Paclitaxel |
| InChI |
InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38-,40-,45+,46-,47+/m0/s1
|
| SMILES |
CC(=O)OC5C(=O)C7(C)(C(O)CC1OCC1(OC(C)=O)C7(C(OC(=O)c2ccccc2)C6(O)(CC(OC(=O)C(O)C(NC(=O)c3ccccc3)c4ccccc4)C(C)=C5C6(C)(C))))
|
| External Links | |
| KEGG-COMPOUND-ID |
C07394
|
| PUBCHEM-ID | 9598 |
| ChEBI-ID |
45863
|
| METANETX-ID | MNXM819836 |
| BioModels |
45863 |
|
View all entries for compound: Paclitaxel |