TPCN04389

Name Z-Onjisaponin H
Molecular Formula C74H110O34
Molecular Weight 1543.66
CAS Registry Number 945674-71-5
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 0.000933% 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