TPCN05535
![[object Object]](../../static/browser_molecular_png/TPCN05535.png)
| Name | Olean-12-en-28-oic acid, 2,3,19,23,24-pentahydroxy-11-oxo-, ??-D-glucopyranosyl ester, (2??,3??,19??)- (ACI) |
| Molecular Formula | C36H56O13 |
| Molecular Weight | 696.83 |
| CAS Registry Number | 920502-27-8 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CC(=O)C4C5(C)CC(O)C(O)C(CO)(CO)C5CCC43C)C2C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asphodelaceae | Pteleopsis suberosa | Barks | 0.000247% | Phytochemistry. 2006. 67, 2623-2629. | 10.1016/j.phytochem.2006.07.017 |
Properties
| HBA | 13 | HBD | 9 |
| HeavyAtoms | 49 | AlogP | -0.44 |
| TPSA | 234.67 | RotatableBonds | 5 |
| FractionCSP3 | 0.89 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |