TPCN00369

Name 6??-O-??-D-Glucopyranosylalbiflorin
Molecular Formula C29H38O16
Molecular Weight 642.61
CAS Registry Number 1001644-88-7
SMILES CC12CC(O)C3CC1(OC1OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C1O)C3(COC(=O)c1ccccc1)C(=O)O2
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia lactiflora Roots 0.000400% Arch Pharm Res, 2007, 30, 1179-1185. 10.1007/bf02980258
Properties
HBA 16 HBD 8
HeavyAtoms 45 AlogP -3.69
TPSA 251.36 RotatableBonds 9
FractionCSP3 0.72 Rings 7
AromaticRings 1 AliphaticRings 6