TPCN02820
![[object Object]](../../static/browser_molecular_png/TPCN02820.png)
| Name | 16-hydroxy-pentandralactone |
| Molecular Formula | C20H28O5 |
| Molecular Weight | 348.44 |
| CAS Registry Number | 2256053-41-3 |
| SMILES | CC1=C(C=O)CC2C1(C)CCC(C)C2(C)CC(O)C1=CC(=O)OC1O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Vitex cofassus | Leaves | 0.000240% | Chem Pharm Bull (Tokyo) 65, 116-120 (2017). | 10.1248/cpb.c16-00775 |
Properties
| HBA | 5 | HBD | 2 |
| HeavyAtoms | 25 | AlogP | 2.52 |
| TPSA | 83.83 | RotatableBonds | 4 |
| FractionCSP3 | 0.70 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |