TPCN02351
| Name | 3??,5??,7??,8??,15??-Pentaacetoxy-2??-benzoyloxyjatropha-6(17),11E-dien-9,14-dione |
| Molecular Formula | C37H44O14 |
| Molecular Weight | 712.75 |
| CAS Registry Number | 205870-79-7 |
| SMILES | C=C1C(OC(C)=O)C(OC(C)=O)C(=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)(OC(=O)c3ccccc3)C(OC(C)=O)C2C1OC(C)=O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Euphorbiaceae | Euphorbia turczaninowii | Whole plants | 0.002250% | J Nat Prod 64, 1064-1068 (2001). | 10.1021/np010015q |
Properties
| HBA | 14 | HBD | 0 |
| HeavyAtoms | 51 | AlogP | 3.58 |
| TPSA | 191.94 | RotatableBonds | 7 |
| FractionCSP3 | 0.51 | Rings | 3 |
| AromaticRings | 1 | AliphaticRings | 2 |