TPCN03772
Name | Hupehensis saponin F |
Molecular Formula | C82H134O44 |
Molecular Weight | 1823.93 |
CAS Registry Number | 186885-10-9 |
SMILES | CC1OC(OC2C(CO)OC(OCC3OC(OC4C(C)OC(OC5C(CO)OC(OCC6OC(OC(=O)C78CCC(C)(C)CC7C7=CCC9C%10(C)CCC(OC%11OCC(O)C(O)C%11OC%11OC(C)C(O)C(OC%12OCC(O)C(O)C%12O)C%11O)C(C)(CO)C%10CCC9(C)C7(C)CC8)C(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Gentianaceae | Comastoma pedunculatum | Aerial parts | 0.000756% | J Asian Nat Prod Res 17, 239-247 (2015). | 10.1080/10286020.2014.984699 |
Properties
HBA | 44 | HBD | 25 |
HeavyAtoms | 126 | AlogP | -9.58 |
TPSA | 688.96 | RotatableBonds | 23 |
FractionCSP3 | 0.96 | Rings | 14 |
AromaticRings | 0 | AliphaticRings | 14 |