epothilone A
(HESCAJZNRMSMJG-KKQRBIROSA-N)
Structure
- SMILES
- O=C1O[C@@H](C[C@@H]2O[C@@H]2CCC[C@@H]([C@@H]([C@H](C(=O)C([C@H](C1)O)(C)C)C)O)C)/C(=C/c1csc(n1)C)/C
- Molecular Formula:
- C26H39NO6S
- Molecular Weight:
- 493.656
- Log P:
- 4.0874
- Hydrogen Bond Acceptor:
- 8
- Hydrogen Bond Donor:
- 2
- TPSA:
- 137.49
- CAS Number(s):
- 152044-53-6
Synonym(s)
1.
epothilone A
2.
epothilon A
External Link(s)
| MeSH | C093787 |
| PubChem Compound | 448799 |
| ChEBI | 94722 31549 |
| CHEMBL | CHEMBL329993 |
| KEGG | cpd:C12153 |
| ZINC | 3951738 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Chromosome Breakage | 29117515 | CTD | |
| 2 | Necrosis | 22995584 | CTD |
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