TPCN01785
![[object Object]](../../static/browser_molecular_png/TPCN01785.png)
| Name | Jatrophadioxan |
| Molecular Formula | C25H28O5 |
| Molecular Weight | 408.49 |
| CAS Registry Number | 1192839-20-5 |
| SMILES | C=C(C)C1CCC(C)C23Oc4c(c(OC)cc5ccc(=O)oc45)OC2CC(C)=C3C1 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Euphorbiaceae | Jatropha integerrima | Roots | 0.000120% | J Nat Prod 72(11): 2024-2027.(2009) | 10.1021/np900342b |
Properties
| HBA | 5 | HBD | 0 |
| HeavyAtoms | 30 | AlogP | 5.41 |
| TPSA | 57.90 | RotatableBonds | 2 |
| FractionCSP3 | 0.48 | Rings | 5 |
| AromaticRings | 2 | AliphaticRings | 3 |