TPCN00113

Name Desbenzoyloxypaeoniflorin
Molecular Formula C16H24O10
Molecular Weight 376.36
CAS Registry Number 23532-11-8
SMILES CC12CC3(O)OC(O1)C1(CO)C3CC21OC1OC(CO)C(O)C(O)C1O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia obovata Roots 0.004055% Chem Pharm Bull (Tokyo), 2000, 48, 201-207. 10.1248/cpb.48.201
Properties
HBA 10 HBD 6
HeavyAtoms 26 AlogP -3.22
TPSA 158.30 RotatableBonds 4
FractionCSP3 1.00 Rings 7
AromaticRings 0 AliphaticRings 7