isoalantolactone
(CVUANYCQTOGILD-QVHKTLOISA-N)
Structure
- SMILES
- O=C1O[C@H]2[C@@H](C1=C)C[C@@H]1[C@](C2)(C)CCCC1=C
- Molecular Formula:
- C15H20O2
- Molecular Weight:
- 232.318
- Log P:
- 3.2406
- Hydrogen Bond Acceptor:
- 2
- Hydrogen Bond Donor:
- 0
- TPSA:
- 26.3
- CAS Number(s):
- 470-17-7
Synonym(s)
1.
isoalantolactone
External Link(s)
| MeSH | C032787 |
| PubChem Compound | 73285 |
| BindingDB | 50433448 |
| ChEBI | 5981 |
| CHEMBL | CHEMBL137803 |
| KEGG | cpd:C09484 |
| ZINC | 3882003 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Neoplasms, Experimental | 29800641 | CTD |
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