TPCN04359
Name | E-Onjisaponin H |
Molecular Formula | C74H110O34 |
Molecular Weight | 1543.66 |
CAS Registry Number | 945674-70-4 |
SMILES | COc1ccc(C=CC(=O)OC2C(C)OC(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(O)C7O)C(C)(C(=O)O)C6CCC5(C)C3(CO)CC4)C(OC3OC(C)C(OC4OCC(O)C(O)C4O)C(OC4OCC(O)(CO)C4O)C3O)C2OC2OC(C)C(O)C(O)C2O)cc1 |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Polygalaceae | Polygala tenuifolia | Roots | 0.001167% | J Asian Nat Prod Res 8(6): 499-503. | 10.1080/10286020500173358 |
Properties
HBA | 34 | HBD | 17 |
HeavyAtoms | 108 | AlogP | -2.74 |
TPSA | 524.34 | RotatableBonds | 20 |
FractionCSP3 | 0.82 | Rings | 12 |
AromaticRings | 1 | AliphaticRings | 11 |