cucurbitacin B
(IXQKXEUSCPEQRD-DKRGWESNSA-N)
Structure
- SMILES
- CC(=O)OC(/C=C/C(=O)[C@@]([C@H]1[C@H](O)C[C@@]2([C@]1(C)CC(=O)[C@@]1([C@H]2CC=C2[C@H]1C[C@H](O)C(=O)C2(C)C)C)C)(O)C)(C)C
- Molecular Formula:
- C32H46O8
- Molecular Weight:
- 558.703
- Log P:
- 3.4993
- Hydrogen Bond Acceptor:
- 8
- Hydrogen Bond Donor:
- 3
- TPSA:
- 138.2
- CAS Number(s):
- 6199-67-3
Synonym(s)
1.
cucurbitacin B
2.
cucurbitacin B 2-sulfate
External Link(s)
| MeSH | C041246 |
| PubChem Compound | 5281316 |
| ChEBI | 3941 |
| CHEMBL | CHEMBL508185 |
| KEGG | cpd:C08794 |
| ZINC | 4097797 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Liver Cirrhosis, Experimental | 29250925 | CTD | |
| 2 | Necrosis | 29250925 | CTD |
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