chempirical

Deoxyguanosine 5′-monophosphate disodium salt

C10H12N5Na2O7PCAS 33430-61-4391.19 g/mol

Open in Covalent MOL file
NHNHONNOHOPO−O−OONHNa+Na+
AlcoholEtherPhenolPhosphate

Properties

Molecular formula
C10H12N5Na2O7P
Molar mass
391.19 g/mol
Exact mass
391.0270 Da
logP
-2.06Crippen estimate
Polar surface area
186.8 Ų
H-bond donors / acceptors
6 / 8
Rotatable bonds
4
Stereocentres
R, S, Rin SMILES atom order

Identifiers

CAS number
33430-61-4
SMILES
N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](COP([O-])([O-])=O)O3)c2[nH]1.[Na+].[Na+]
InChIKey
ACQHIRQGBXPFOH-FVALZTRZSA-N
InChI
InChI=1S/C10H14N5O7P.2Na/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(22-6)2-21-23(18,19)20;;/h3-6,16H,1-2H2,(H2,18,19,20)(H3,11,13,14,17);;/t4-,5+,6+;;/m0../s1

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Names and synonyms

8 names
  • 5′-Guanylic acid, 2′-deoxy-, sodium salt (1:2)
  • Guanosine, 2′-deoxy-, 5′-(dihydrogen phosphate), disodium salt
  • 5′-Guanylic acid, 2′-deoxy-, disodium salt
  • Disodium deoxy-5′-guanylate
  • Deoxyguanosine 5′-phosphate disodium salt
  • 2′-Deoxyguanosine 5′-phosphate disodium salt
  • 5′-DGMP disodium salt
  • Disodium 5′-dGMP

Work with Deoxyguanosine 5′-monophosphate 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

Deoxyguanosine monophosphate902-04-576 % similar Sodium 2′-deoxyguanosine 5′-(tetrahydrogen triphosphate) (3:1)93919-41-675 % similar Disodium guanylate5550-12-972 % similar Deoxyguanosine961-07-966 % similar Cyclic 3′,5′-guanosine monophosphate monosodium salt40732-48-759 % similar 2′-Deoxycytidine 5′-phosphate disodium salt13085-50-259 % similar Deoxyadenosine 5′-monophosphate disodium salt2922-74-958 % similar Guanosine 5′-diphosphate disodium salt7415-69-256 % similar

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

Same formula

Adenosine 5′-monophosphate disodium4578-31-8

Elsewhere

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