Metabolomics Structure Database

 
MW REGNO: 37509
Common Name:UDP-glucuronic acid
Systematic Name:Uridine 5'-diphosphate alpha-D-Glucopyranuronic acid
RefMet Name:UDP-glucuronic acid
Synonyms:Uridine 5'-diphosphoglucuronic acid [PubChem Synonyms]
Exact Mass:
580.0343 (neutral)    Calculate m/z:
Formula:C15H22N2O18P2
InChIKey:HDYANYHVCAPMJV-LXQIFKJMSA-N
ClassyFire superclass:Nucleosides, nucleotides, and analogues [C0000289]
ClassyFire class:Pyrimidine nucleotides [C0001509]
ClassyFire subclass:Pyrimidine nucleotide sugars [C0001296]
ClassyFire direct parent:Pyrimidine nucleotide sugars [C0001296]
MoNA MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:O=C(O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
Studies:Available studies (via RefMet name)

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External database links:

PubChem CID:17473
CHEBI ID:17200
HMDB ID:HMDB0000935
KEGG ID:C00167
Chemspider ID:16522
METLIN ID:5884
BMRB ID:bmse000292
MetaCyc ID:UDP-GLUCURONATE
NP-MRD ID(NMR):NP0000134
Plant Metabolite Hub(Pmhub):MS000005694

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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