TPCN05944

Name Albesoside-A
Molecular Formula C58H92O28
Molecular Weight 1237.35
CAS Registry Number 242470-95-7
SMILES CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C(C)(C(=O)O)C6CCC5(C)C3(C)CC4)OCC(O)C2O)C(O)C(O)C1OC1OCC(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Medicago truncatula Aerial parts 0.009600% J Agric Food Chem . 2005 Mar 23;53(6):2164-70 10.1021/jf048178i
Properties
HBA 28 HBD 16
HeavyAtoms 86 AlogP -3.87
TPSA 450.12 RotatableBonds 13
FractionCSP3 0.93 Rings 10
AromaticRings 0 AliphaticRings 10