TPCN03896
![[object Object]](../../static/browser_molecular_png/TPCN03896.png)
| Name | 2alpha,3alpha,23-trihydroxyurs-12,19(29)-dien-28-oic acid beta-D-glucopyranosyl ester |
| Molecular Formula | C36H56O10 |
| Molecular Weight | 648.83 |
| CAS Registry Number | 1135502-99-6 |
| SMILES | C=C1C(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C12 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rosaceae | Rosa laevigata | Roots | 0.000367% | Molecules 13, 2229-2237 (2008). | 10.3390/molecules13092229 |
Properties
| HBA | 10 | HBD | 7 |
| HeavyAtoms | 46 | AlogP | 2.21 |
| TPSA | 177.14 | RotatableBonds | 4 |
| FractionCSP3 | 0.86 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |