TPCN02754
![[object Object]](../../static/browser_molecular_png/TPCN02754.png)
| Name | 16-acetylkirenol |
| Molecular Formula | C22H36O5 |
| Molecular Weight | 380.53 |
| CAS Registry Number | 137143-42-1 |
| SMILES | CC(=O)OCC(O)C1(C)C=C2CCC3C(C)(CO)CC(O)CC3(C)C2CC1 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Siegesbeckia orientalis | Aerial parts | 0.000300% | J Nat Prod 67, 1517-1521 (2004). | 10.1021/np0400407 |
Properties
| HBA | 5 | HBD | 3 |
| HeavyAtoms | 27 | AlogP | 2.82 |
| TPSA | 86.99 | RotatableBonds | 4 |
| FractionCSP3 | 0.86 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |