TPCN05865
![[object Object]](../../static/browser_molecular_png/TPCN05865.png)
| Name | 3b-hydroxy-27-(4-acetyl)-(Z)-cinnamoyl-lup-20(29)-en-28-oic acid |
| Molecular Formula | C41H56O6 |
| Molecular Weight | 644.89 |
| CAS Registry Number | 1373888-48-2 |
| SMILES | C=C(C)C1CCC2(C(=O)O)CCC3(COC(=O)C=Cc4ccc(C(C)=O)cc4)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apocynaceae | Nerium oleander | Leaves | 0.000043% | Phytochemistry. 2012 May;77:238-44. | 10.1016/j.phytochem.2012.01.001 |
Properties
| HBA | 6 | HBD | 2 |
| HeavyAtoms | 47 | AlogP | 8.53 |
| TPSA | 100.90 | RotatableBonds | 7 |
| FractionCSP3 | 0.68 | Rings | 6 |
| AromaticRings | 1 | AliphaticRings | 5 |