Products 1314116-53-4

CAS 1314116-53-4 appears in our catalog under these names: Clopidogrel Acyl-beta-D-Glucuronide, Clopidogrel Impurity 97, Clopidogrel-β-D-glucuronide. Offered by: Chemat Brand, Hubei YoungXin, MedChemExpress. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg, Get quote.

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

(2S,3S,4S,5R,6S)-6-[(2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 1314116-53-4) is a chemical compound with the molecular formula C21H22ClNO8S and a molecular weight of 483.9 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[(2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: TUBQAJBXTWIXFX-CLCCAKIRSA-N.

Identity
Molecular formulaC21H22ClNO8S
Molecular weight483.9 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[(2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyTUBQAJBXTWIXFX-CLCCAKIRSA-N
SMILESC1CN(CC2=C1SC=C2)[C@@H](C3=CC=CC=C3Cl)C(=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O

Computed by PubChem (NCBI)