TPCN04828
Name | 3-O-??-glucuronopyranosyl-28-O-??-glucopyranoside medicagenic acid;Saponin 12 |
Molecular Formula | C42H64O17 |
Molecular Weight | 840.96 |
CAS Registry Number | 849699-60-1 |
SMILES | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(C(=O)O)C5CCC43C)C2C1 |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Fabaceae | Medicago hybrida | Roots | 0.053333% | J Agric Food Chem 54, 2520-2526 (2006) | 10.1021/jf0581628 |
Fabaceae | Medicago truncatula | Aerial parts | 0.001067% | J Agric Food Chem . 2005 Mar 23;53(6):2164-70 | 10.1021/jf048178i |
Properties
HBA | 17 | HBD | 10 |
HeavyAtoms | 59 | AlogP | 0.44 |
TPSA | 290.43 | RotatableBonds | 7 |
FractionCSP3 | 0.88 | Rings | 7 |
AromaticRings | 0 | AliphaticRings | 7 |