TPCN02225
| Name | (1S,2S,3aR,5S,6E,10R,11S,13R,13aR)-1,3a,10,13-Tetrakis(acetyloxy)-11-(benzoyloxy)-2,3,3a,5,8,10,11,12,13,13a-decahydro-2,5,8,8-tetramethyl-12-methylene-1H-cyclopentacyclododecene-4,9-dione |
| Molecular Formula | C35H42O12 |
| Molecular Weight | 654.71 |
| CAS Registry Number | 362681-79-6 |
| SMILES | C=C1C(OC(=O)c2ccccc2)C(OC(C)=O)C(=O)C(C)(C)C=CC(C)C(=O)C2(OC(C)=O)CC(C)C(OC(C)=O)C2C1OC(C)=O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Euphorbiaceae | Euphorbia turczaninowii | Whole plants | 0.006217% | J Nat Prod 64, 1064-1068 (2001). | 10.1021/np010015q |
Properties
| HBA | 12 | HBD | 0 |
| HeavyAtoms | 47 | AlogP | 3.89 |
| TPSA | 165.64 | RotatableBonds | 6 |
| FractionCSP3 | 0.51 | Rings | 3 |
| AromaticRings | 1 | AliphaticRings | 2 |