TPCN05922

Name 3-O[??-L-arabinopyranosyl (1-2)][??-L arabinopyranosyl (1-6)]2-acetoamido-2-deoxy-??-D-glucopyranosyl oleanolic acid
Molecular Formula C48H77NO16
Molecular Weight 924.14
CAS Registry Number 189366-57-2
SMILES CC(=O)NC1C(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)O)CCC34C)C2(C)C)OC(COC2OCC(O)C(O)C2OC2OCC(O)C(O)C2O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Zygia racemosa Barks 0.030000% Pharm Res . 1997 Mar;14(3):358-61 10.1023/a:1012010407824
Properties
HBA 17 HBD 9
HeavyAtoms 65 AlogP 2.13
TPSA 263.39 RotatableBonds 9
FractionCSP3 0.92 Rings 8
AromaticRings 0 AliphaticRings 8