TPCN04218

Name Polygalasaponin F
Molecular Formula C53H86O23
Molecular Weight 1091.25
CAS Registry Number 882664-74-6
SMILES CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(O)C7O)C(C)(CO)C6CCC5(C)C3(C)CC4)OC(CO)C(O)C2O)C(O)C(O)C1OC1OCC(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Polygalaceae Polygala japonica Roots 0.008000% Fitoterapia 83(7): 1184-1190. 10.1016/j.fitote.2012.07.002
Properties
HBA 23 HBD 14
HeavyAtoms 76 AlogP -2.43
TPSA 374.13 RotatableBonds 11
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9