| Compound Information | |
|---|---|
| ID | 703 |
| TrivialName | Oleanolic acid |
| Type | OA |
| MF | C₃₀H₄₈O₃ |
| MolecularWeight | 456.711 |
| IUPACName | (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| m/z | NT |
| Retention Time | NT |
| CCS | NT |
| Adducts | NT |
| Isomeric SMILES | O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)[C@]2([H])CC=C4[C@@]3(C)CC[C@]5(C(O)=O)C4CC(C)(C)CC5)C1(C)C |
| Canonical SMILES | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
| Source | PJvm |
| Functions | Anti-inflammatory |
| Toxicity Organism | rat, rat, mouse, mouse |
| Toxicity Type | LD50, LD50, LD50, LD50 |
| Toxicity Route | oral, intraperitoneal, oral, intraperitoneal |
| Toxicity Dose | >2 gm/kg,>2 gm/kg,>2 gm/kg, 1500 mg/kg |
| Year | 2011 |
| References | |
| Structure |
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