TPCN02083

Name Phyllaemblicins H13
Molecular Formula C38H52O24
Molecular Weight 892.81
CAS Registry Number 1799849-93-6
SMILES CC1COC2(CC1OC(=O)c1ccc(O)cc1)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 0.000003% Phytochemistry 117: 123-134.(2015) 10.1016/j.phytochem.2015.06.001
Properties
HBA 24 HBD 12
HeavyAtoms 62 AlogP -6.23
TPSA 377.04 RotatableBonds 10
FractionCSP3 0.76 Rings 7
AromaticRings 1 AliphaticRings 6