TPCN03616
![[object Object]](../../static/browser_molecular_png/TPCN03616.png)
| Name | 3-O-beta-glucopyranosylquinovic acid 28-O-alpha-arabinopyranosyl-(1-->2)-beta-glucopyranosyl ester |
| Molecular Formula | C47H74O19 |
| Molecular Weight | 943.09 |
| CAS Registry Number | 866546-25-0 |
| SMILES | CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3OC3OCC(O)C(O)C3O)CCC3(C(=O)O)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rubiaceae | Cephalanthus occidentalis | Barks | 0.001700% | Planta Med 71, 355-361 (2005). | 10.1055/s-2005-864103 |
Properties
| HBA | 19 | HBD | 11 |
| HeavyAtoms | 66 | AlogP | -0.30 |
| TPSA | 312.05 | RotatableBonds | 9 |
| FractionCSP3 | 0.91 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |