TPCN00442

Name 9-hydroxy-paeonilactone-A;9hydroxypaeonilactone A
Molecular Formula C10H14O5
Molecular Weight 214.22
CAS Registry Number 476487-58-8
SMILES CC1(O)CC2OC(=O)C(CO)C2CC1=O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia delavayi Roots 0.000280% J Asian Nat Prod Res, 2002, 4, 135-140. 10.1080/10286020290027425
Paeoniaceae Paeonia lactiflora Roots 0.000160% Fitoterapia, 2014, 98, 124-129. 10.1016/j.fitote.2014.07.017
Properties
HBA 5 HBD 2
HeavyAtoms 15 AlogP -0.75
TPSA 83.83 RotatableBonds 1
FractionCSP3 0.80 Rings 2
AromaticRings 0 AliphaticRings 2