Metabolomics Structure Database

 
MW REGNO: 37773
Common Name:Guanosine monophosphate
Systematic Name:{[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
RefMet Name:GMP
Synonyms: [PubChem Synonyms]
Exact Mass:
363.0580 (neutral)    Calculate m/z:
Formula:C10H14N5O8P
InChIKey:RQFCJASXJCIDSX-UUOKFMHZSA-N
ClassyFire superclass:Nucleosides, nucleotides, and analogues [C0000289]
ClassyFire class:Purine nucleotides [C0001506]
ClassyFire subclass:Purine ribonucleotides [C0001544]
ClassyFire direct parent:Purine ribonucleoside monophosphates [C0001617]
MoNA MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:C([C@@H]1[C@H]([C@H]([C@H](n2cnc3c2nc(N)[nH]c3=O)O1)O)O)OP(=O)(O)O
Studies:Available studies (via RefMet name)

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External database links:

PubChem CID:135398631
CHEBI ID:17345
HMDB ID:HMDB0001397
KEGG ID:C00144
Chemspider ID:6545
METLIN ID:6216
MetaCyc ID:GMP
NP-MRD ID(NMR):NP0001228
Plant Metabolite Hub(Pmhub):MS000007703

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

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