TPCN06001
![[object Object]](../../static/browser_molecular_png/TPCN06001.png)
| Name | Hederagenin 3-O-(2-O-acetyl-??-D-xylopyranosyl)-(1??3)-??-L-rhamnopyranosyl-(1??2)-??-L-arabinopyranoside |
| Molecular Formula | C48H76O17 |
| Molecular Weight | 925.12 |
| CAS Registry Number | 372104-50-2 |
| SMILES | CC(=O)OC1C(OC2C(O)C(C)OC(OC3C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7CC(C)(C)CCC7(C(=O)O)CCC56C)C4(C)CO)OCC(O)C3O)C2O)OCC(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Sapindaceae | Sapindus emarginatus | Peels | 0.003375% | Chem Pharm Bull (Tokyo) . 2001 Sep;49(9):1195-7 | 10.1248/cpb.49.1195 |
Properties
| HBA | 17 | HBD | 8 |
| HeavyAtoms | 65 | AlogP | 2.56 |
| TPSA | 260.59 | RotatableBonds | 9 |
| FractionCSP3 | 0.92 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |