TPCN04852

Name Robinoside E
Molecular Formula C48H78O19
Molecular Weight 959.13
CAS Registry Number 149691-29-2
SMILES CC1OC(OC2C(OC3C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7CC(C)(CO)CC(O)C7(C)CCC56C)C4(C)CO)OC(C(=O)O)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Glycine max Seeds 0.024138% Planta Med 75, 371-374 (2009). 10.1055/s-0028-1112221
Properties
HBA 19 HBD 12
HeavyAtoms 67 AlogP -0.32
TPSA 315.21 RotatableBonds 10
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8