TPCN04767

Name Uralsaponin O;Licorice-saponin E;Licorice-saponin E2
Molecular Formula C42H60O16
Molecular Weight 820.93
CAS Registry Number 119417-96-8
SMILES CC12CC(OC1=O)C1(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(C)C5CCC43C)C1C2
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Glycyrrhiza uralensis Roots 0.000035% Fitoterapia 133: 186-192. 10.1016/j.fitote.2019.01.014
Fabaceae Glycyrrhiza uralensis Roots 0.000014% J Nat Prod. 2014 Jul 25;77(7):1632-43. 10.1021/np500253m.
Fabaceae Glycyrrhiza uralensis Roots 0.000010% Fitoterapia 133: 186-192. 10.1016/j.fitote.2019.01.014
Properties
HBA 16 HBD 7
HeavyAtoms 58 AlogP 1.70
TPSA 256.04 RotatableBonds 6
FractionCSP3 0.86 Rings 8
AromaticRings 0 AliphaticRings 8