TPCN03718
![[object Object]](../../static/browser_molecular_png/TPCN03718.png)
| Name | Quinoa saponin 7;3-O-??-Dglucopyranosyl-(1??2)-??-D-glucopyranosyl-(1??3)-??-L-arabinopyranosyl oleanolic acid 28-O-??-D-glucopyranosyl ester |
| Molecular Formula | C53H86O22 |
| Molecular Weight | 1075.25 |
| CAS Registry Number | 128866-17-1 |
| SMILES | CC1(C)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)C7OC7OC(CO)C(O)C(O)C7O)C6O)C(C)(C)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Symplocaceae | Symplocos lancifolia | Leaves | 0.001000% | J Nat Prod, 2011, 74, 163-169. | 10.1021/np100502y |
| Amaranthaceae | Chenopodium quinoa | Seeds | 0.000667% | Phytochemistry . 2008 Jun;69(9):1919-26 | 10.1016/j.phytochem.2008.03.001 |
Properties
| HBA | 22 | HBD | 13 |
| HeavyAtoms | 75 | AlogP | -1.40 |
| TPSA | 353.90 | RotatableBonds | 11 |
| FractionCSP3 | 0.94 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |