Products 4002-09-9

CAS 4002-09-9 is the registry number for 3-Acetylpyridinehypoxanthinedinucleotide, 95%. Offered by: Chemat Brand. Available pack sizes: on request.

3-Acetylpyridinehypoxanthinedinucleotide, 95%
Chemat Brand
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Structural formula: {0} (CAS {1})

[(3S,4R,5S)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[(2R,4R)-3,4-dihydroxy-5-(6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphate (CAS 4002-09-9) is a chemical compound with the molecular formula C22H27N5O15P2 and a molecular weight of 663.4 g/mol. IUPAC name: [(3S,4R,5S)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[(2R,4R)-3,4-dihydroxy-5-(6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphate. InChIKey: OFZRVBGRUHGJOH-TWGMSDHDSA-N.

Identity
Molecular formulaC22H27N5O15P2
Molecular weight663.4 g/mol
IUPAC name[(3S,4R,5S)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[(2R,4R)-3,4-dihydroxy-5-(6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphate
InChIKeyOFZRVBGRUHGJOH-TWGMSDHDSA-N
SMILESCC(=O)C1=C[N+](=CC=C1)[C@@H]2[C@@H]([C@@H](C(O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3C([C@H](C(O3)N4C=NC5=C4N=CNC5=O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: 3-Acetylpyridine deamino nad