TPCN00562

Name 4-O-methylmoudanpioside C
Molecular Formula C31H34O13
Molecular Weight 614.60
CAS Registry Number 1458048-20-8
SMILES COC12CC3(C)OC(O1)C1(COC(=O)c4ccccc4)C2CC31OC1OC(COC(=O)c2ccc(O)cc2)C(O)C(O)C1O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia suffruticosa Roots 0.000136% Fitoterapia, 2012, 83, 1598-1605. 10.1016/j.fitote.2012.09.008
Properties
HBA 13 HBD 4
HeavyAtoms 44 AlogP 0.87
TPSA 179.67 RotatableBonds 9
FractionCSP3 0.55 Rings 9
AromaticRings 2 AliphaticRings 7