Metabolomics Structure Database

 
MW REGNO: 50326
Common Name:Aldehydo-D-glucose 6-phosphate
Systematic Name:aldehydo-D-glucose 6-(dihydrogen phosphate)
Synonyms:(2R,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl dihydrogen phosphate [PubChem Synonyms]
Exact Mass:
260.0297 (neutral)    Calculate m/z:
Formula:C6H13O9P
InChIKey:VFRROHXSMXFLSN-SLPGGIOYSA-N
ClassyFire superclass:Organic oxygen compounds [C0004603]
ClassyFire class:Organooxygen compounds [C0000323]
ClassyFire subclass:Carbohydrates and carbohydrate conjugates [C0000011]
ClassyFire direct parent:Monosaccharide phosphates [C0001541]
SMILES:C(=O)[C@@H]([C@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)O
Studies:Available studies(via PubChem CID)

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External database links:

PubChem CID:439958
CHEBI ID:15954

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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