chempirical

Adenosine 5'-monophosphate sodium salt

C10H13N5NaO7PCAS 13474-03-8369.21 g/mol

Open in Covalent MOL file
H2NNNNNOOPO−OHOOHHONa+
AlcoholEtherPhosphatePrimary amine

Properties

Molecular formula
C10H13N5NaO7P
Molar mass
369.21 g/mol
Exact mass
369.0450 Da
logP
-2.24Crippen estimate
Polar surface area
186.1 Ų
H-bond donors / acceptors
5 / 9
Rotatable bonds
4
Stereocentres
R, R, S, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
13474-03-8
SMILES
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP([O-])(=O)O)[C@@H](O)[C@H]1O.[Na+]
InChIKey
JWJUYEHEBGNNAE-MCDZGGTQSA-N
InChI
InChI=1S/C10H14N5O7P.Na/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20;/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20);/t4-,6-,7-,10-;/m1./s1

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Names and synonyms

7 names
  • Amp sodium salt
  • 5′-Adenylic acid, sodium salt (1:?)
  • 5′-Adenylic acid, sodium salt
  • Sodium AMP
  • Sodium adenosine-5′-monophosphate
  • 5′-AMP sodium salt
  • Adenosine 5′-monophosphate sodium salt

Work with Adenosine 5'-monophosphate sodium salt

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Adenosine 5'-monophosphate monohydrate18422-05-4Hydrate Adenosine monophosphate61-19-8Free acid Vidarabine phosphate29984-33-6Free acid, diastereomer Adenosine 5′-monophosphate disodium4578-31-8Salt

Similar compounds

Adenosine-5′-diphosphate disodium salt16178-48-685 % similar Adenosine 5'-diphosphate dipotassium salt114702-55-577 % similar Sodium adenosine 5′-diphosphate20398-34-975 % similar Trisodium adenosine 5′-diphosphate2092-65-174 % similar ATP disodium987-65-573 % similar 3′,5′-cAMP sodium salt37839-81-969 % similar Adenosine 5′-(trihydrogen diphosphate), trilithium salt31008-64-767 % similar Adenosine diphosphate58-64-067 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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