TPCN02084

Name Phyllaemblicins H1
Molecular Formula C35H46O20
Molecular Weight 786.73
CAS Registry Number 1799849-81-2
SMILES CC(=O)OCC1OC(OC(=O)C2CC(O)C3(O)C(=O)C4(CC(OC(=O)c5ccccc5)C(C)CO4)OC3C2)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O
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 20 HBD 8
HeavyAtoms 55 AlogP -3.83
TPSA 303.96 RotatableBonds 9
FractionCSP3 0.71 Rings 6
AromaticRings 1 AliphaticRings 5