Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0W2EK
|
|||
| Former ID |
DAP001562
|
|||
| Drug Name |
Ixabepilone
|
|||
| Synonyms |
Azaepothilone B; BMS-247550; Ixempra (TN)
Click to Show/Hide
|
|||
| Drug Type |
Small molecular drug
|
|||
| Indication | Breast cancer [ICD-11: 2C60-2C65] | Approved | [1], [2], [3] | |
| Company |
Bristol-Myers Squibb
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C27H42N2O5S
|
|||
| Canonical SMILES |
CC1CCCC2(C(O2)CC(NC(=O)CC(C(C(=O)C(C1O)C)(C)C)O)C(=CC3=CSC(=N3)C)C)C
|
|||
| InChI |
1S/C27H42N2O5S/c1-15-9-8-10-27(7)22(34-27)12-20(16(2)11-19-14-35-18(4)28-19)29-23(31)13-21(30)26(5,6)25(33)17(3)24(15)32/h11,14-15,17,20-22,24,30,32H,8-10,12-13H2,1-7H3,(H,29,31)/b16-11+/t15-,17+,20-,21-,22-,24-,27+/m0/s1
|
|||
| InChIKey |
FABUFPQFXZVHFB-PVYNADRNSA-N
|
|||
| CAS Number |
CAS 219989-84-1
|
|||
| PubChem Compound ID | ||||
| PubChem Substance ID |
11969810, 14786763, 14933557, 34184371, 47206488, 49684213, 49999545, 57369862, 76567192, 91148449, 103771488, 114573104, 126623101, 126665598, 127325936, 127325937, 127325938, 127325939, 134223036, 135135146, 135610851, 137240334, 137248706, 140173305, 152258135, 160646974, 162202446, 175267394, 176484667, 178103430, 179150167, 184022005, 184529017, 184812276, 221678841, 223664545, 226399596, 228058699, 241053227, 248880927, 251910828, 252448545
|
|||
| ChEBI ID |
CHEBI:63605
|
|||
| ADReCS Drug ID | BADD_D01222 | |||
| SuperDrug ATC ID |
L01DC04
|
|||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Tubulin (TUB) | Target Info | Stablizer | [3] |
| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 6824). | |||
| REF 2 | 2007 FDA drug approvals: a year of flux. Nat Rev Drug Discov. 2008 Feb;7(2):107-9. | |||
| REF 3 | Mullard A: 2010 FDA drug approvals. Nat Rev Drug Discov. 2011 Feb;10(2):82-5. | |||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.