TPCN04021

Name Uralsaponins F;Uralsaponin F
Molecular Formula C44H64O19
Molecular Weight 896.98
CAS Registry Number 1208004-79-8
SMILES CC(=O)OC1CC(C)(C(=O)O)CC2C3=CC(=O)C4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(CO)C5CCC4(C)C3(C)CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Schisandraceae Kadsura ananosma Stems 0.000140% J Nat Prod, 2010, 73, 12-16. 10.1021/np900506g
Fabaceae Glycyrrhiza uralensis Roots 0.000075% Fitoterapia 133: 186-192. 10.1016/j.fitote.2019.01.014
Properties
HBA 19 HBD 9
HeavyAtoms 63 AlogP 0.76
TPSA 313.57 RotatableBonds 9
FractionCSP3 0.84 Rings 7
AromaticRings 0 AliphaticRings 7