chempirical

Guanosine 5′-diphosphate disodium salt

C10H13N5Na2O11P2CAS 7415-69-2487.17 g/mol

Open in Covalent MOL file
NHNHONNOOPO−OOPO−OHOOHOHNHNa+Na+
AlcoholEtherPhenolPhosphate

Properties

Molecular formula
C10H13N5Na2O11P2
Molar mass
487.17 g/mol
Exact mass
486.9882 Da
logP
-2.97Crippen estimate
Polar surface area
253.6 Ų
H-bond donors / acceptors
8 / 11
Rotatable bonds
6
Stereocentres
R, R, S, Rin SMILES atom order

Identifiers

CAS number
7415-69-2
SMILES
N=c1nc(O)c2ncn([C@@H]3O[C@H](COP([O-])(=O)OP([O-])(=O)O)[C@@H](O)[C@H]3O)c2[nH]1.[Na+].[Na+]
InChIKey
AGBCSLHXZKGTLG-LGVAUZIVSA-N
InChI
InChI=1S/C10H15N5O11P2.2Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21;;/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18);;/t3-,5-,6-,9-;;/m1../s1

Weigh it out

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

Names and synonyms

6 names
  • Guanosine 5′-(trihydrogen diphosphate), sodium salt (1:2)
  • Guanosine trihydrogen pyrophosphate, disodium salt
  • Guanosine 5′-(trihydrogen diphosphate), disodium salt
  • Guanosine pyrophosphate, disodium salt
  • 5′-GDP disodium salt
  • Disodium guanosine 5′-diphosphate

Work with Guanosine 5′-diphosphate disodium 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

Similar compounds

5′-Gtp trisodium salt36051-31-797 % similar Guanosine 5′-triphosphoric acid disodium salt56001-37-783 % similar Disodium guanylate5550-12-977 % similar Cyclic 3′,5′-guanosine monophosphate monosodium salt40732-48-775 % similar Guanosine 5′-(trihydrogen diphosphate), P′-D-mannopyranosyl ester, disodium salt103301-73-175 % similar Sodium 2′-deoxyguanosine 5′-(tetrahydrogen triphosphate) (3:1)93919-41-673 % similar Guanosine monophosphate85-32-571 % similar Guanosine diphosphate146-91-869 % similar

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

Elsewhere

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