TPCN05468
Name | Mutongsaponin F |
Molecular Formula | C64H102O31 |
Molecular Weight | 1367.49 |
CAS Registry Number | 1233192-31-8 |
SMILES | C=C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1 |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Lardizabalaceae | Akebia trifoliata | Stems | 0.000600% | J Asian Nat Prod Res. 2009. 11, 1013-1018. | 10.1080/10286020903213439. |
Properties
HBA | 31 | HBD | 18 |
HeavyAtoms | 95 | AlogP | -5.19 |
TPSA | 491.97 | RotatableBonds | 16 |
FractionCSP3 | 0.92 | Rings | 11 |
AromaticRings | 0 | AliphaticRings | 11 |