TPCN02079

Name Phyllaemblicins C
Molecular Formula C38H52O23
Molecular Weight 876.81
CAS Registry Number 307504-15-0
SMILES CC1COC2(CC1OC(=O)c1ccccc1)OC1CC(C(=O)OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3OC3OCC(O)C(O)C3O)CC(O)C1(O)C2=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Phyllanthus emblica Roots 0.000005% Phytochemistry 117: 123-134.(2015) 10.1016/j.phytochem.2015.06.001
Properties
HBA 23 HBD 11
HeavyAtoms 61 AlogP -5.93
TPSA 356.81 RotatableBonds 10
FractionCSP3 0.76 Rings 7
AromaticRings 1 AliphaticRings 6