TPCN02523

Name Pisumoside A
Molecular Formula C38H62O21
Molecular Weight 854.89
CAS Registry Number 333334-42-2
SMILES CC1(C(=O)OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)CCCC2(C)C1C(O)C(O)C13CC(COC4OC(CO)C(O)C(O)C4O)C(O)(CCC21)C3
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Pisum sativum Seeds 0.000833% Chem Pharm Bull (Tokyo) 49, 73-77 (2001). 10.1248/cpb.49.73
Properties
HBA 21 HBD 14
HeavyAtoms 59 AlogP -5.94
TPSA 355.67 RotatableBonds 10
FractionCSP3 0.97 Rings 7
AromaticRings 0 AliphaticRings 7