TPCN04272

Name Saponin 6
Molecular Formula C55H84O26
Molecular Weight 1161.25
CAS Registry Number 1542229-61-7
SMILES CC(=O)OC1C(C)OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CC(O)C(OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(C(=O)O)C5CCC4(C)C2(C)CC3O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OCC(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Sapindaceae Zanha golungensis Barks 0.002700% Carbohydr Res 402: 225-231. 10.1016/j.carres.2014.10.001
Properties
HBA 26 HBD 13
HeavyAtoms 81 AlogP -1.67
TPSA 414.34 RotatableBonds 11
FractionCSP3 0.89 Rings 9
AromaticRings 0 AliphaticRings 9