TPCN00499

Name 6'-O-benzoylalbiflorin
Molecular Formula C30H32O13
Molecular Weight 600.57
CAS Registry Number 476487-57-7
SMILES CC12CC(O)C3CC1(OC1OC(COC(=O)c4ccccc4)C(O)C(O)C1O)C3(COC(=O)c1ccc(O)cc1)C(=O)O2
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia delavayi Roots 0.000200% J Asian Nat Prod Res, 2002, 4, 135-140. 10.1080/10286020290027425
Properties
HBA 13 HBD 5
HeavyAtoms 43 AlogP 0.06
TPSA 198.51 RotatableBonds 8
FractionCSP3 0.50 Rings 7
AromaticRings 2 AliphaticRings 5