Adenosine 5'-(trihydrogen diphosphate)

Basic Information

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CAS Number

58-64-0

Molecular Formula

C10H15N5O10P2

Molecular Weight

427.2 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

Agricultural Chemicals Pesticides Insecticides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

No data available

Boiling Point

196°C

Density

2.49

Flash Point

484.6°C

Vapor Pressure

No data available

SMILES

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C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N

InChI

InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1

InChIKey

XTWYTFMLZFPYCI-KQYNXXCUSA-N

LogP

-1.7460000000000004

Topological Polar Surface Area

232.59999999999997 Å²

Hydrogen Bond Donor/Acceptor

7 / 15

Complexity

638

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Sensitiveness

Sensitive to humidity

Synonyms & References

English

Epitope ID:137351
BDBM31995
5'-Adp
adenosine-5'-diphosphate
ADENOSINE DIPHOSPHATE [MI]
Adenosine disphosphate
4-(3-Carboxytrimethyleneoxy)-4/'/'-octylazobenzene
20398-34-9
9H-purin-6-amine, 9-[5-O-[hydroxy(phosphonooxy)phosphinyl]-beta-D-glycero-pentofuranosyl]-
1ucn
Adenosine diphosphate;Adenosine 5'-diphosphate
Adenosine diphosphoric acid
1o0h
adenosine pyrophosphate
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate
adenosine 5' diphosphate
Dynorphin A (1-13), ala(2)-trp(4)-
C10H15N5O10P2
Adenosine-5'-diphosphat
((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl trihydrogen diphosphate
5'-Adenylphosphoric acid
s10970
Adenosine, 5'-(trihydrogen diphosphate)
1,4-Cyclohexadiene-3,3,6,6-d4
s9368
adenosine 5'-pyrophosphate
bmse000991
11062-03-6
Adenosine5'-diphosphate
bmse000935
1amw

MDL Number

MFCD00066473

FAQ

What is Adenosine 5'-(trihydrogen diphosphate) (CAS: 58-64-0)?

Adenosine 5'-(trihydrogen diphosphate), also known as adenosine diphosphate (ADP), is a nucleotide composed of adenine, ribose, and two phosphate groups. Its chemical formula is C10H14N5O10P2. ADP is a key molecule in cellular energy transfer, serving as an intermediate in ATP synthesis and a substrate for various enzymatic reactions. It is commonly used in biochemical research and industrial applications.

What are the main uses of Adenosine 5'-(trihydrogen diphosphate) (CAS: 58-64-0)?

Adenosine 5'-(trihydrogen diphosphate) (ADP) is widely used in pharmaceuticals for drug development targeting metabolic disorders, in research as a cofactor for enzymes like ATPases, and in biotechnology for DNA/RNA studies. It also serves as a precursor in the synthesis of nucleotides for food supplements and industrial chemical processes. Its role in energy metabolism makes it vital for cellular functions and biochemical experiments.

Is Adenosine 5'-(trihydrogen diphosphate) (CAS: 58-64-0) safe?

Adenosine 5'-(trihydrogen diphosphate) (ADP) is generally safe when handled properly, but it requires caution due to potential irritation. Safety data sheets (SDS) recommend wearing gloves, goggles, and lab coats, and working in well-ventilated areas. While not classified as highly toxic, prolonged exposure or ingestion may pose health risks. Always follow standard chemical safety protocols and regulatory guidelines for handling.

How should Adenosine 5'-(trihydrogen diphosphate) (CAS: 58-64-0) be stored?

Adenosine 5'-(trihydrogen diphosphate) (ADP) should be stored in a cool, dry place, away from light, in airtight containers. Maintain storage temperature between 2-8°C for stability. Avoid moisture exposure to prevent hydrolysis, and ensure containers are made of non-reactive materials like glass or plastic. Proper storage preserves its chemical integrity and extends shelf life.