TPCN00571

Name Suffruyabiosides B
Molecular Formula C36H42O17
Molecular Weight 746.72
CAS Registry Number 1415968-07-8
SMILES CC12CC3(O)OC(O1)C1(COC(=O)c4ccccc4)C3CC21OC1OC(CO)C(OC2OC(COC(=O)c3ccccc3)C(O)C(O)C2O)C(O)C1O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Paeonia suffruticosa Roots 0.000130% Molecules, 2012, 17, 4915-4923. 10.3390/molecules17054915
Properties
HBA 17 HBD 7
HeavyAtoms 53 AlogP -1.67
TPSA 249.59 RotatableBonds 11
FractionCSP3 0.61 Rings 10
AromaticRings 2 AliphaticRings 8