TPCN04842

Name Antoniosides F
Molecular Formula C66H106O33
Molecular Weight 1427.54
CAS Registry Number 1372626-17-9
SMILES CC=C(C)C(=O)OC1C(OC(C)=O)C2(CO)C(CC1(C)C)C1=CCC3C4(C)CCC(OC5OC(COC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(CO)C4CCC3(C)C1(C)C(O)C2O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Loganiaceae Antonia ovata Leaves 0.033200% Phytochemistry 77, 268-274 (2012) 10.1016/j.phytochem.2012.01.025
Properties
HBA 33 HBD 19
HeavyAtoms 99 AlogP -6.16
TPSA 529.27 RotatableBonds 19
FractionCSP3 0.91 Rings 10
AromaticRings 0 AliphaticRings 10