TPCN05989
![[object Object]](../../static/browser_molecular_png/TPCN05989.png)
| Name | 3-O-??-D-glucopyranosyl-(1??3)-??-L-arabinopyranosyl 3??,23,30-trihydroxy olean-12-en-28-oic acid 28-O-??-D-glucopyranosyl ester |
| Molecular Formula | C47H76O19 |
| Molecular Weight | 945.11 |
| CAS Registry Number | 898565-67-8 |
| SMILES | CC1(CO)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Amaranthaceae | Chenopodium quinoa | Seeds | 0.004000% | Phytochemistry . 2008 Jun;69(9):1919-26 | 10.1016/j.phytochem.2008.03.001 |
Properties
| HBA | 19 | HBD | 12 |
| HeavyAtoms | 66 | AlogP | -1.28 |
| TPSA | 315.21 | RotatableBonds | 10 |
| FractionCSP3 | 0.94 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |