adenosine 5'-(trihydrogen diphosphate), monosodium salt
Basic information
- CAS
1172-42-5- Standard SMILES
Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)([O-])O)C(O)C1O.[Na+]- InChIKey
NYEHFIIOXORNJT-UHFFFAOYSA-M- Molecular formula
- C10H14N5NaO10P2
- Average molar mass
- 449.18 g/mol
- Monoisotopic mass
- 449.01135994
Names & identifiers
- Preferred name
- adenosine 5'-(trihydrogen diphosphate), monosodium salt
- IUPAC
- sodium [[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate
- English name
- adenosine5’-diphosphate,monosodiumsaltdihydrate
- Molecular formula
- C10H12N5Na2O7P
- Molecular weight
- 450.19
Names & synonyms
Adenosine 5'-(trihydrogen diphosphate), monosodium saltRefChem:552990214-631-6Sodium ADPAdenosine5'-diphosphate,monosodiumsaltdihydrateSCHEMBL31158049Adenosine-5?-diphosphate monosodium saltNSC 20267Adenosine-5'-MonophosphateDisodiumAdenosine5-DiphosphoricAcidTrisodiumSalt(Adp)adenosine5’-diphosphate,monosodiumsaltdihydrateadenosine5’-(trihydrogendiphosphate),monosodiumsalt
Show more names
ADENOSINE 5'-DIPHOSPHONATE MONOSODIUM SALT BIOTEC...5′-Inosinic acid, homopolymer, complex with 5′-cytidylic acid homopolymer (1:1), potassium salt (9CI, ACI)Sodium ((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl dihydrogendiphosphate
Database identifiers
- CAS
1172-42-5- PubChem CID
- 4145993
- EC Number
- 214-631-6
Properties
Computed structural properties
- Topological polar surface area
- 235 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 650
Physicochemical properties
- EPA Substance Registry System
- 5 · Adenosine 5'-(trihydrogen diphosphate), monosodium salt (1172-42-5)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Adenosine 5'-(trihydrogen diphosphate), monosodium salt
Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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