bufalin
(QEEBRPGZBVVINN-BMPKRDENSA-N)
Structure
- SMILES
- O[C@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@]1(O)CC[C@@H]2c1ccc(=O)oc1)C)C
- Molecular Formula:
- C24H34O4
- Molecular Weight:
- 386.524
- Log P:
- 4.2419
- Hydrogen Bond Acceptor:
- 4
- Hydrogen Bond Donor:
- 2
- TPSA:
- 70.67
- CAS Number(s):
- 465-21-4
Synonym(s)
1.
bufalin
2.
bufalin, (3alpha,5beta)-isomer
External Link(s)
| MeSH | C022777 |
| PubChem Compound | 9547215 |
| ChEBI | 517248 |
| CHEMBL | CHEMBL399680 |
| KEGG | cpd:C16922 |
| ZINC | 4215121 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Neoplasm Invasiveness | 23949904 | CTD | |
| 2 | Neoplasms, Experimental | 23091618 27444971 | CTD | |
| 3 | Osteosarcoma | 23091618 | CTD |
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