oleanolic acid 3-acetate
(RIXNFYQZWDGQAE-DFHVBEEKSA-N)
Structure
- SMILES
- CC(=O)O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C)(C)CC1)C(=O)O)C)C
- Molecular Formula:
- C32H50O4
- Molecular Weight:
- 498.737
- Log P:
- 7.8044
- Hydrogen Bond Acceptor:
- 4
- Hydrogen Bond Donor:
- 1
- TPSA:
- 63.6
- CAS Number(s):
- 4339-72-4
Synonym(s)
1.
oleanolic acid 3-acetate
2.
3-O-acetyloleanolic acid
3.
3-acetyloleanolic acid
External Link(s)
| MeSH | C052658 |
| PubChem Compound | 151202 |
| BindingDB | 50102741 |
| CHEMBL | CHEMBL486822 |
| ZINC | 3964583 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Dermatitis, Atopic | 23499868 | CTD |
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