TPCN00467

Name Paeonins A
Molecular Formula C17H24O9
Molecular Weight 372.37
CAS Registry Number 1155280-57-1
SMILES COCC1=COC2(OC3OC(CO)C(O)C(O)C3O)CC1C(=O)C=C2C
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia lactiflora Roots 0.000240% J Nat Prod, 2009, 72, 1321-1324. 10.1021/np8001783
Properties
HBA 9 HBD 4
HeavyAtoms 26 AlogP -1.41
TPSA 134.91 RotatableBonds 5
FractionCSP3 0.71 Rings 3
AromaticRings 0 AliphaticRings 3