TPCN05359

Name Medicagenic acid(2??, 3??, 16a, 28-tetrahydroxy olean-12-ene-23-oic acid)
Molecular Formula C30H46O6
Molecular Weight 502.69
CAS Registry Number 599-07-5
SMILES CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C(=O)O)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Iridaceae Gladiolus segetum Subterraneous stems 0.002500% Nat Prod Res. 2009. 23, 613-616. 10.1080/14786410802114142.
Properties
HBA 6 HBD 4
HeavyAtoms 36 AlogP 5.27
TPSA 115.06 RotatableBonds 2
FractionCSP3 0.87 Rings 5
AromaticRings 0 AliphaticRings 5