TPCN05474

Name 3b-{O-b-D-glucopyranosyl-(1 4 2)-[O-a-Larabinopyranosyl(1 4 6)]b-D-glucopyranosyloxy}-machaerinic acid g-lactone
Molecular Formula C47H74O17
Molecular Weight 911.09
CAS Registry Number 281654-63-5
SMILES CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CCC23CC1OC3=O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Albizia gummifera Barks 0.000588% Phytochemistry. 2000. 53, 885-892. 10.1016/s0031-9422(99)00464-1.
Properties
HBA 17 HBD 9
HeavyAtoms 64 AlogP 0.80
TPSA 263.75 RotatableBonds 8
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9