Products 1260617-50-2

CAS 1260617-50-2 appears in our catalog under these names: Trandolapril Acyl-beta-D-glucuronide, 85%, Trandolapril acyl -beta-D-glucuronide, Trandolapril acyl-β-D-glucuronide. Offered by: TRC, Iris Biotech, Biosynth. Available pack sizes: 1mg, 5mg, 10mg, 50mg, 25mg.

Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6S)-6-[(2S,3aR,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 1260617-50-2) is a chemical compound with the molecular formula C30H42N2O11 and a molecular weight of 606.7 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[(2S,3aR,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: XIVXFEAPQLOONX-UCXQGGPXSA-N.

Identity
Molecular formulaC30H42N2O11
Molecular weight606.7 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[(2S,3aR,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyXIVXFEAPQLOONX-UCXQGGPXSA-N
SMILESCCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2[C@H]3CCCC[C@@H]3C[C@H]2C(=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O

Computed by PubChem (NCBI)