TPCN05347

Name 3b-[O-b-D-glucopyranosiduronic acid (1 4 2)-bD-glucopyranosyloxy]-machaerinic acid g-lactone
Molecular Formula C42H64O14
Molecular Weight 792.96
CAS Registry Number 281654-64-6
SMILES CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6OC6OC(C(=O)O)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 0.003059% Phytochemistry. 2000. 53, 885-892. 10.1016/s0031-9422(99)00464-1.
Properties
HBA 14 HBD 7
HeavyAtoms 56 AlogP 2.43
TPSA 221.90 RotatableBonds 6
FractionCSP3 0.90 Rings 8
AromaticRings 0 AliphaticRings 8