TPCN00383

Name Paeonisuffrone
Molecular Formula C10H14O4
Molecular Weight 198.22
CAS Registry Number 149420-73-5
SMILES CC12CC(=O)C3CC1(O)C3(CO)CO2
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia lactiflora Roots 0.000372% Fitoterapia, 2014, 98, 124-129. 10.1016/j.fitote.2014.07.017
Properties
HBA 4 HBD 2
HeavyAtoms 14 AlogP -0.52
TPSA 66.76 RotatableBonds 1
FractionCSP3 0.90 Rings 4
AromaticRings 0 AliphaticRings 4