Disodium nicotinamide adenine dinucleotide

Base Information

• Chemical Name: Disodium nicotinamide adenine dinucleotide
• CAS No.: 606-68-8
• Molecular Formula: C21H27N7Na2O14P2
• Molecular Weight: 709.41
• Hs Code.: 29349990
• European Community (EC) Number: 210-123-3
• UNII: 8295030YNC
• DSSTox Substance ID: DTXSID901014657
• Wikidata: Q27269326
• Mol file: 606-68-8.mol

Synonyms:606-68-8;Disodium nicotinamide adenine dinucleotide;Disodium NADH;NADH disodium salt;beta-Nicotinamide Adenine Dinucleotide Disodium Salt;NADH, disodium salt hydrate;NADH (disodium salt);UNII-8295030YNC;EINECS 210-123-3;8295030YNC;Reduced beta-nicotinamide adenine dinucleotide disodium salt;disodium;[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate;Dihydronicotinamide-adenine dinucleotide, disodium salt;Nicotinamide-adenine dinucleotide, reduced, disodium salt;Adenosine 5'-(trihydrogen diphosphate), P'.fwdarw.5'-ester with 1,4-dihydro-1-beta-D-ribofuranosyl-3-pyridinecarboxamide, disodium salt;C21H29N7O14P2.2Na;C21-H29-N7-O14-P2.2Na;NADH-Dinatriumsalz;Cozymase Disodium Salt;Adenosine 5'-(trihydrogen diphosphate), 5'.fwdarw.5'-ester with 1,4-dihydro-1-.beta.-D-ribofuranosyl-3-pyridinecarboxamide, disodium salt;Adenosine 5'-(trihydrogen diphosphate), P'.fwdarw.5'-ester with 1,4-dihydro-1-.beta.-D-ribofuranosyl-3-pyridinecarboxamide, disodium salt;Adenosine 5'-(trihydrogen diphosphate), P'?5'-ester with 1,4-dihydro-1-.beta.-D-ribofuranosyl-3-pyridinecarboxamide, disodium salt;beta-DPNH Disodium Salt;beta-NADH Disodium Salt;Coenzyme I Disodium Salt;DISODIUM NADH [INCI];DTXSID901014657;MFCD00036200;AKOS024306766;AC-37029;AS-75103;D0920;beta-Nicotinamideadeninedinucleotidedisodiumsalt;beta-Diphosphopyridine Nucleotide Disodium Salt;C75833;NICOTINAMIDE ADENINE DINUCLEOTIDE DISODIUM;Q27269326;DISODIUM NICOTINAMIDE ADENINE DINUCLEOTIDE REDUCED;NICOTINAMIDE ADENINE DINUCLEOTIDE DISODIUM REDUCED;beta-Nicotinamide adenine dinucleotide reduced disodium salt;.BETA.-NICOTINAMIDE ADENINE DINUCLEOTIDE DISODIUM SALT;((2R,3S,4R,5R)-5-(6-Aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl)methoxy-((((2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl)methoxy)hydroxyphosphoryl)oxyphosphinic acid disodium salt;Adenosine 5'-(trihydrogen diphosphate), 5'->'-ester with 1,4-dihydro-1-beta-D-ribofuranosyl-3-pyridinecarboxamide, disodium salt;Adenosine 5'-(trihydrogen diphosphate), P'->5'-ester with 1,4-dihydro-1-beta-D-ribofuranosylnicotinamide, sodium salt (1:2);disodium [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl ({[(2R,3S,4R,5R)-5-(3-carbamoyl-1,4-dihydropyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphonato}oxy)phosphonate

Chemical Property of Disodium nicotinamide adenine dinucleotide

Chemical Property:

• Appearance/Colour: beige powder
• Vapor Pressure: 0.73Pa at 20-50℃
• Melting Point: 140-142°C
• Boiling Point: 1081.8 °C at 760 mmHg
• Flash Point: 608 °C
• PSA: 342.90000
• Density: 1.955 at 20℃
• LogP: -0.59060
• Storage Temp.: 2-8°C
• Solubility.: H2O: 50 mg/mL, clear to nearly clear, yellow
• Water Solubility.: soluble
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 11
• Exact Mass: 709.08866112
• Heavy Atom Count: 46
• Complexity: 1210

Purity/Quality:

98%, ^*data from raw suppliers

b-Nicotinamide adenine dinucleotide reduced form, disodium salt ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 23/24/25-36/37/38-39/23/24/25-40-22
• Safety Statements: 26-36/37/39-45-24/25-36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1C=CN(C=C1C(=O)N)C2C(C(C(O2)COP(=O)([O-])OP(=O)([O-])OCC3C(C(C(O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O.[Na+].[Na+]
• Isomeric SMILES: C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O.[Na+].[Na+]
• Description: β-Nicotinamide adenine dinucleotide (NAD+) and β-Nicotinamide adenine dinucleotide, reduced (NADH) comprise a coenzyme redox pair (NAD+:NADH) involved in a wide range of enzyme catalyzed oxidation reduction reactions. In addition to its redox function, NAD+/NADH is a donor of ADP-ribose units in ADP-ribosylaton (ADP-ribosyltransferases; poly(ADP-ribose) polymerases ) reactions and a precursor of cyclic ADP-ribose (ADP-ribosyl cyclases).As a reagent, NADH can be used in enzyme cycling assays to amplify detection of activity of biologically relevant enzymes or metabolites present in low concentrations.
• Uses: One of the biologically active forms of nicotinic acid. Serves as a coenzyme of hydrogenases and dehydrogenases. NAD usually acts as a hydrogen acceptor, forming NADH which then serves as a hydrogen d onor in the respiratory chain. Present in living cells primarily in the reduced form (NADPH) and is involved in synthetic reactions. Occurs in 2 forms, α-NAD and β-NAD, distinguished by the configura tion of the ribosyl nicotinamide linkage. Only the β-anomer is bioactive. One of the biologically active forms of nicotinic acid. Serves as a coenzyme of hydrogenases and dehydrogenases. NAD usually acts as a hydrogen acceptor, forming NADH which then serves as a hydrogen donor in the respiratory chain. Present in living cells primarily in the reduced form (NADPH) and is involved in synthetic reactions. Occurs in 2 forms, α-NAD and β-NAD, distinguished by the configuration of the ribosyl nicotinamide linkage. Only the β-anomer is bioactive. β-Nicotinamide adenine dinucleotide, reduced disodium salt has been used in the preparation of standard curve.