TPCN05875

Name Uralsaponin P
Molecular Formula C42H64O16
Molecular Weight 824.96
CAS Registry Number 1616062-81-7
SMILES CC12CCC3(C)C(=CC(=O)C4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C1CC(C)(C(=O)O)C(O)C2
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Glycyrrhiza uralensis Roots 0.000023% J Nat Prod. 2014 Jul 25;77(7):1632-43. 10.1021/np500253m.
Properties
HBA 16 HBD 9
HeavyAtoms 58 AlogP 1.12
TPSA 270.20 RotatableBonds 7
FractionCSP3 0.88 Rings 7
AromaticRings 0 AliphaticRings 7