TPCN05365

Name 3-O-??-D-galactopyranosyl-(1 ?? 2)-[??-D-xylopyranosyl-(1 ?? 3)]-??-D-glucuronopyranosylgypsogenin 28-O-??-Dxylopyranosyl-(1 ?? 3)-??-D-xylopyranosyl-(1 ?? 4)-??-L-rhamnopyranosyl-(1 ?? 2)-[(4-O-acetyl)-??-D-quinovopyranosyl-(1 ?? 4)]-??-D-fucopyranosyl ester
Molecular Formula C77H120O40
Molecular Weight 1685.77
CAS Registry Number 1605299-41-9
SMILES CC(=O)OC1C(C)OC(OC2C(C)OC(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(OC7OC(C(=O)O)C(O)C(OC8OCC(O)C(O)C8O)C7OC7OC(CO)C(O)C(O)C7O)C(C)(C=O)C6CCC5(C)C3(C)CC4)C(OC3OC(C)C(OC4OCC(O)C(OC5OCC(O)C(O)C5O)C4O)C(O)C3O)C2O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Crassulaceae Acanthophyllum glandulosum Roots 0.002400% Planta Med. 2016. 82, 1553-1557. 10.1055/s-0042-110575
Properties
HBA 40 HBD 19
HeavyAtoms 117 AlogP -5.90
TPSA 609.56 RotatableBonds 20
FractionCSP3 0.92 Rings 13
AromaticRings 0 AliphaticRings 13