chempirical

Disodium 5′-cytidylate

C9H12N3Na2O8PCAS 6757-06-8367.16 g/mol

Open in Covalent MOL file
HNNOOPO−O−OOHHOOHNNa+Na+
AlcoholEtherPhenolPhosphate

Properties

Molecular formula
C9H12N3Na2O8P
Molar mass
367.16 g/mol
Exact mass
367.0157 Da
logP
-2.96Crippen estimate
Polar surface area
178.3 Ų
H-bond donors / acceptors
6 / 8
Rotatable bonds
4
Stereocentres
R, R, S, Rin SMILES atom order

Identifiers

CAS number
6757-06-8
SMILES
N=c1ccn([C@@H]2O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H]2O)c(O)n1.[Na+].[Na+]
InChIKey
PNPLHKHBANFGMS-WFIJOQBCSA-N
InChI
InChI=1S/C9H14N3O8P.2Na/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18;;/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18);;/t4-,6-,7-,8-;;/m1../s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all
  • 5′-Cytidylic acid, sodium salt (1:2)
  • 5′-Cytidylic acid, disodium salt
  • Disodium 5′-CMP
  • CMP disodium salt
  • Disodium cytidine 5′-phosphate
  • Cytidine monophosphate disodium salt
  • Cytidine 5′-monophosphate sodium
  • Sodium 5′-cytidylate
  • Disodium cytidine 5′-monophosphate
  • 5′-CMP disodium salt
  • Cytidine 5′-monophosphate disodium salt
  • Disodium CMP
  • NSC 20259

Work with Disodium 5′-cytidylate

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

Similar compounds

Trisodium cytidine 5′-diphosphate34393-59-485 % similar Polycytidylic acid30811-80-472 % similar Cytidine monophosphate63-37-672 % similar Cytidine-5′-triphosphate disodium salt36051-68-072 % similar Cytidine-5′-triphosphate sodium salt18423-42-270 % similar 2′-Deoxycytidine 5′-phosphate disodium salt13085-50-269 % similar Disodium ump3387-36-869 % similar Citicoline sodium33818-15-468 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook