TPCN05370
![[object Object]](../../static/browser_molecular_png/TPCN05370.png)
| Name | (16??)-16-Hydroxy-3-oxoolean-12-en-28-al (ACI) |
| Molecular Formula | C30H46O3 |
| Molecular Weight | 454.70 |
| CAS Registry Number | 943719-88-8 |
| SMILES | CC1(C)CCC2(C=O)C(O)CC3(C)C(=CCC4C5(C)CCC(=O)C(C)(C)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ligularia odontomanes | Whole plants | 0.002250% | Chem Pharm Bull (Tokyo). 2007. 55, 577-579. | 10.1248/cpb.55.577 |
Properties
| HBA | 3 | HBD | 1 |
| HeavyAtoms | 33 | AlogP | 6.53 |
| TPSA | 54.37 | RotatableBonds | 1 |
| FractionCSP3 | 0.87 | Rings | 5 |
| AromaticRings | 0 | AliphaticRings | 5 |