TPCN01387
![[object Object]](../../static/browser_molecular_png/TPCN01387.png)
| Name | Hydroxyvernolide;3??-hydroxyvernolide |
| Molecular Formula | C19H22O8 |
| Molecular Weight | 378.38 |
| CAS Registry Number | 27470-84-4 |
| SMILES | C=C(CO)C(=O)OC1CC23OC2CCC(=CC2OC(=O)C(=C)C21)COC3O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Vernonia cinerascens | Aerial parts | 0.000583% | Molecules 23(2).(2018) | 10.3390/molecules23020248 |
| Asteraceae | Vernonia amygdalina | Leaves | 0.000267% | J Nat Prod 78(7): 1618-1623.(2015) | 10.1021/acs.jnatprod.5b00179 |
Properties
| HBA | 8 | HBD | 2 |
| HeavyAtoms | 27 | AlogP | 0.14 |
| TPSA | 114.82 | RotatableBonds | 3 |
| FractionCSP3 | 0.58 | Rings | 5 |
| AromaticRings | 0 | AliphaticRings | 5 |