Products 7531-49-9

CAS 7531-49-9 is the registry number for N,N'-Diacetyl-3,6,3',4',6'-penta-O-acetyl-1-chlorochitobioside. Offered by: Biosynth. Available pack sizes: 50mg, 25mg, 100mg, 250mg, 500mg.

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

[(3S,6S)-5-acetamido-6-[(3S,6R)-5-acetamido-4-acetyloxy-2-(acetyloxymethyl)-6-chlorooxan-3-yl]oxy-3,4-diacetyloxyoxan-2-yl]methyl acetate (CAS 7531-49-9) is a chemical compound with the molecular formula C26H37ClN2O15 and a molecular weight of 653.0 g/mol. IUPAC name: [(3S,6S)-5-acetamido-6-[(3S,6R)-5-acetamido-4-acetyloxy-2-(acetyloxymethyl)-6-chlorooxan-3-yl]oxy-3,4-diacetyloxyoxan-2-yl]methyl acetate. InChIKey: ZIRWPGALWMJCOT-PIXUPOCSSA-N.

Identity
Molecular formulaC26H37ClN2O15
Molecular weight653.0 g/mol
IUPAC name[(3S,6S)-5-acetamido-6-[(3S,6R)-5-acetamido-4-acetyloxy-2-(acetyloxymethyl)-6-chlorooxan-3-yl]oxy-3,4-diacetyloxyoxan-2-yl]methyl acetate
InChIKeyZIRWPGALWMJCOT-PIXUPOCSSA-N
SMILESCC(=O)NC1[C@@H](OC([C@H](C1OC(=O)C)OC(=O)C)COC(=O)C)O[C@@H]2C(O[C@@H](C(C2OC(=O)C)NC(=O)C)Cl)COC(=O)C

Computed by PubChem (NCBI)