TPCN06161
![[object Object]](../../static/browser_molecular_png/TPCN06161.png)
| Name | 3-[(O-??-D-glucopyranosyl-(1??3)-??-D-xylopyranosyl)oxy]olean-12-ene-28,29-dioic acid |
| Molecular Formula | C41H64O14 |
| Molecular Weight | 780.95 |
| CAS Registry Number | 1260096-72-7 |
| SMILES | CC1(C(=O)O)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(C)(C)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Zygophyllaceae | Larrea tridentata | Aerial parts | 0.000447% | Phytochemistry . 2010 Dec;71(17-18):2157-67 | 10.1016/j.phytochem.2010.09.012 |
Properties
| HBA | 14 | HBD | 8 |
| HeavyAtoms | 55 | AlogP | 2.59 |
| TPSA | 232.90 | RotatableBonds | 7 |
| FractionCSP3 | 0.90 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |