Molecule: abacavir 5'-glucuronide
A glucosiduronic acid derivative formed by linkage of beta-D-glucosiduronic acid with the 5'-oxygen of abacavir. One of the two major metabolites of abacavir in humans (the other is the 5'-carboxylic acid, CHEBI:64192).
Synonyms for abacavir 5'-glucuronide :
361W
abacavir 5'-glucosiduronic acid
abacavir glucosiduronic acid
abacavir glucuronide
Molecular Formula: C20H26N6O7
Molecular wt: 462.45640 g/mole
Charge: 0
SMILES: Nc1nc(NC2CC2)c2ncn([C@@H]3C[C@H](CO[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)C=C3)c2n1
InChIKey: WGTDUQBKKUUVMK-OLMRCODSSA-N
InChI=1S/C20H26N6O7/c21-20-24-16(23-9-2-3-9)11-17(25-20)26(7-22-11)10-4-1-8(5-10)6-32-19-14(29)12(27)13(28)15(33-19)18(30)31/h1,4,7-10,12-15,19,27-29H,2-3,5-6H2,(H,30,31)(H3,21,23,24,25)/t8-,10+,12+,13+,14-,15+,19-/m1/s1
Sample reactions for this molecule: