TPCN00613

Name 8-debenzoylpaeonidanin
Molecular Formula C17H26O10
Molecular Weight 390.39
CAS Registry Number 84808-29-7
SMILES COC1OC2(C)CC(=O)C3CC2(OC2OC(CO)C(O)C(O)C2O)C13CO
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia lactiflora Roots 0.000100% J Nat Prod, 2009, 72, 1321-1324. 10.1021/np8001783
Properties
HBA 10 HBD 5
HeavyAtoms 27 AlogP -2.73
TPSA 155.14 RotatableBonds 5
FractionCSP3 0.94 Rings 5
AromaticRings 0 AliphaticRings 5