TPCN05409

Name B-D-glucopyranosyl(1 4 2)-b-D-glucopyranosyl{3-O-b-D-glucopyranosyl(1 4 2)-[a-L-arabinopyranosyl(1 4 6)]-b-D-glucopyranosyl}-oleanolate
Molecular Formula C59H96O27
Molecular Weight 1237.39
CAS Registry Number 281654-62-4
SMILES CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Albizia gummifera Barks 0.001412% Phytochemistry. 2000. 53, 885-892. 10.1016/s0031-9422(99)00464-1.
Properties
HBA 27 HBD 16
HeavyAtoms 86 AlogP -3.57
TPSA 433.05 RotatableBonds 14
FractionCSP3 0.95 Rings 10
AromaticRings 0 AliphaticRings 10