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

Basic Information

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CAS Number

606-68-8

Molecular Formula

C21H27N7Na2O14P2

Molecular Weight

709.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Insecticides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

140-142°C

Boiling Point

Vapour density:

Flash Point

608 °C

Solubility

H2O: 50 mg/mL, clear to nearly clear, yellow

SMILES

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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+]

InChI

InChI=1S/C21H29N7O14P2.2Na/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33;;/h1,3-4,7-8,10-11,13-16,20-21,29-32H,2,5-6H2,(H2,23,33)(H,34,35)(H,36,37)(H2,22,24,25);;/q;2*+1/p-2/t10-,11-,13-,14-,15-,16-,20-,21-;;/m1../s1

InChIKey

QRGNQKGQENGQSE-WUEGHLCSSA-L

LogP

-0.59060

Complexity

1210

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Stability

Stable. Incompatible with strong oxidizing agents.

Synonyms & References

English

NADH (disodium salt)
EINECS 210-123-3
Dihydronicotinamide-adenine dinucleotide, disodium salt
NADH-Dinatriumsalz
Adenosine 5'-(trihydrogen diphosphate), P'.fwdarw.5'-ester with 1,4-dihydro-1-.beta.-D-ribofuranosyl-3-pyridinecarboxamide, disodium salt
Coenzyme I Disodium Salt
NICOTINAMIDE ADENINE DINUCLEOTIDE DISODIUM REDUCED
UNII-8295030YNC
beta-Nicotinamideadeninedinucleotidedisodiumsalt
Disodium NADH
((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
NADH, disodium salt hydrate
beta-Nicotinamide Adenine Dinucleotide Disodium Salt
Reduced beta-nicotinamide adenine dinucleotide disodium salt
AKOS024306766
DISODIUM NICOTINAMIDE ADENINE DINUCLEOTIDE REDUCED
C21H29N7O14P2.2Na
D0920
Cozymase Disodium Salt
C21-H29-N7-O14-P2.2Na
C75833
beta-DPNH Disodium Salt
DISODIUM NADH [INCI]
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
8295030YNC
NICOTINAMIDE ADENINE DINUCLEOTIDE DISODIUM
beta-Nicotinamide adenine dinucleotide reduced disodium salt
DTXSID901014657
Adenosine 5'-(trihydrogen diphosphate), P'->5'-ester with 1,4-dihydro-1-beta-D-ribofuranosylnicotinamide, sodium salt (1:2)
NADH disodium salt
Adenosine 5'-(trihydrogen diphosphate), 5'.fwdarw.5'-ester with 1,4-dihydro-1-.beta.-D-ribofuranosyl-3-pyridinecarboxamide, disodium salt

MDL Number

MFCD03791273

Customs Code

2924199090

FAQ

What is 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 (CAS: 606-68-8)?

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 (CAS: 606-68-8) is a complex organic phosphate compound with potential applications in biochemistry and pharmaceutical research. It contains multiple functional groups, including purine and pyridine rings, and is known for its structural complexity and possible biological activity. The compound is typically used in specialized scientific contexts due to its unique chemical composition.

What are the main uses of 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 (CAS: 606-68-8)?

This compound is primarily used in pharmaceutical and biochemical research, particularly in the development of drugs targeting metabolic pathways. Its structure suggests potential roles in enzyme inhibition and signal transduction studies. It may also find use in specialized industrial applications or as a reagent in organic synthesis. Due to its complexity, it is not commonly used in food or general commercial products.

Is 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 (CAS: 606-68-8) safe?

The safety of 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 (CAS: 606-68-8) depends on its specific application and exposure conditions. As a research chemical, it should be handled with appropriate personal protective equipment (PPE) and in well-ventilated areas. It is advisable to follow safety guidelines from regulatory bodies and consult safety data sheets (SDS) for detailed information.

How should 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 (CAS: 606-68-8) be stored?

This compound should be stored in a cool, dry, and dark place, away from moisture and incompatible substances. It is best kept in a sealed container at a temperature below 25°C. Avoid exposure to light and ensure proper ventilation to maintain stability and safety during storage.