TPCN00518

Name Suffrupaeoniflorin D
Molecular Formula C31H34O12
Molecular Weight 598.60
CAS Registry Number 1528763-64-5
SMILES COC1OC2(C)CC(=O)C3CC2(OC2OC(COC(=O)c4ccccc4)C(O)C(O)C2O)C13COC(=O)c1ccccc1
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia suffruticosa Barks 0.000175% Chem Pharm Bull (Tokyo), 2003, 51, 58-61. 10.1021/np400571x
Properties
HBA 12 HBD 3
HeavyAtoms 43 AlogP 1.00
TPSA 167.28 RotatableBonds 9
FractionCSP3 0.52 Rings 7
AromaticRings 2 AliphaticRings 5