Metabolomics Structure Database

 
MW REGNO: 38436
Common Name:Beta-D-Fructose 6-phosphate
Systematic Name:{[(2R,3S,4S,5R)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methoxy}phosphonic acid
RefMet Name:Fructose 6-phosphate
Synonyms: [PubChem Synonyms]
Exact Mass:
260.0297 (neutral)    Calculate m/z:
Formula:C6H13O9P
InChIKey:BGWGXPAPYGQALX-ARQDHWQXSA-N
ClassyFire superclass:Organic oxygen compounds [C0004603]
ClassyFire class:Organooxygen compounds [C0000323]
ClassyFire subclass:Carbohydrates and carbohydrate conjugates [C0000011]
ClassyFire direct parent:Pentose phosphates [C0002259]
MoNA MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:OC[C@@]1(O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O
Studies:Available studies (via RefMet name)

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External database links:

PubChem CID:440641
CHEBI ID:16084
HMDB ID:HMDB0003971
KEGG ID:C05345
Chemspider ID:389526
NP-MRD ID(NMR):NP0002597

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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