TPCN02389
![[object Object]](../../static/browser_molecular_png/TPCN02389.png)
| Name | (rel 3S,5S,8R,9R,10S)3,9-dihydroxy-13(14)-labden-16,15-olide |
| Molecular Formula | C20H32O4 |
| Molecular Weight | 336.47 |
| CAS Registry Number | 1467744-96-2 |
| SMILES | CC1CCC2C(C)(C)C(O)CCC2(C)C1(O)CCC1=CCOC1=O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Verbenaceae | Vitex negundo | Leaves | 0.001818% | Nat Prod Res, 1-6 (2019). | 10.1080/14786419.2019.1672687 |
Properties
| HBA | 4 | HBD | 2 |
| HeavyAtoms | 24 | AlogP | 3.21 |
| TPSA | 66.76 | RotatableBonds | 3 |
| FractionCSP3 | 0.85 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |