RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0136106
RefMet name	Glucose 6-phosphate
Systematic name	{[(2R,3S,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy}phosphonic acid
Synonyms	PubChem Synonyms
Exact mass	260.029723 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C6H13O9P	View other entries in RefMet with this formula
Molecular descriptors
Molfile	37776 (Download molfile/View MW Metabolite Database details)
InChI	InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6?/m1/s1
InChIKey	NBSCHQHZLSJFNQ-GASJEMHNSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	C([C@@H]1[C@H]([C@@H]([C@H](C(O)O1)O)O)O)OP(=O)(O)O Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Carbohydrates
Main Class	Monosaccharides
Sub Class	Hexose phosphates
Distribution of Glucose 6-phosphate in NMDR studies
Species	Plot Species distribution
Sample source	Plot Sample source(tissue) distribution
Platform	Platform (MS/NMR) used for detection
Chromatography	Chromatography methods used for detection
Studies	NMDR Studies reporting Glucose 6-phosphate
External Links
Pubchem CID	5958
ChEBI ID	4170
KEGG ID	C00092
HMDB ID	HMDB0001401
Chemspider ID	5743
EPA CompTox	DTXCID10207341
Spectral data for Glucose 6-phosphate standards
NP-MRD ID(NMR)	View NMR spectra
MassBank(EU)	View MS spectra
Structural annotation level
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Glucose 6-phosphate

Rxn ID	KEGG Reaction	Enzyme
R00299	ATP + D-Glucose <=> ADP + D-Glucose 6-phosphate	ATP:D-glucose 6-phosphotransferase
R00303	D-Glucose 6-phosphate + H2O <=> D-Glucose + Orthophosphate	D-Glucose-6-phosphate phosphohydrolase
R00771	D-Glucose 6-phosphate <=> D-Fructose 6-phosphate	D-glucose-6-phosphate aldose-ketose-isomerase
R00959	D-Glucose 1-phosphate <=> alpha-D-Glucose 6-phosphate	alpha-D-Glucose 1-phosphate 1,6-phosphomutase
R01600	ATP + beta-D-Glucose <=> ADP + beta-D-Glucose 6-phosphate	ATP:beta-D-glucose 6-phosphotransferase
R01786	ATP + alpha-D-Glucose <=> ADP + alpha-D-Glucose 6-phosphate	ATP:alpha-D-glucose 6-phosphotransferase
R01788	alpha-D-Glucose 6-phosphate + H2O <=> alpha-D-Glucose + Orthophosphate	alpha-D-Glucose 6-phosphate phosphohydrolase
R02189	Polyphosphate + alpha-D-Glucose <=> Polyphosphate + alpha-D-Glucose 6-phosphate	Polyphosphate:D-glucose 6-phosphotransferase
R02736	beta-D-Glucose 6-phosphate + NADP+ <=> D-Glucono-1,5-lactone 6-phosphate + NADPH + H+	beta-D-glucose-6-phosphate:NADP+ 1-oxoreductase
R02738	Protein N(pi)-phospho-L-histidine + D-Glucose <=> Protein histidine + alpha-D-Glucose 6-phosphate	protein-N(pi)-phosphohistidine:D-glucose 6-phosphotransferase
R02739	alpha-D-Glucose 6-phosphate <=> beta-D-Glucose 6-phosphate	alpha-D-Glucose 6-phosphate ketol-isomerase
R02740	alpha-D-Glucose 6-phosphate <=> beta-D-Fructose 6-phosphate	alpha-D-Glucose 6-phosphate ketol-isomerase
R03321	beta-D-Glucose 6-phosphate <=> beta-D-Fructose 6-phosphate	beta-D-Glucose 6-phosphate ketol-isomerase
R07324	D-Glucose 6-phosphate <=> 1D-myo-Inositol 3-phosphate	1D-myo-inositol-3-phosphate lyase (isomerizing)
R08639	D-Glucose 1-phosphate <=> D-Glucose 6-phosphate	alpha-D-glucose 1,6-phosphomutase
R09085	alpha-D-Glucose + ADP <=> alpha-D-Glucose 6-phosphate + AMP	ADP:D-glucose 6-phosphotransferase
R09086	beta-D-Glucose + ADP <=> beta-D-Glucose 6-phosphate + AMP	ADP:D-glucose 6-phosphotransferase
R10907	beta-D-Glucose 6-phosphate + NAD+ <=> D-Glucono-1,5-lactone 6-phosphate + NADH + H+	beta-D-glucose-6-phosphate:NAD+ 1-oxidoreductase

Table of KEGG human pathways containing Glucose 6-phosphate

Pathway ID	Human Pathway	# of reactions
hsa00010	Glycolysis / Gluconeogenesis	9
hsa00500	Starch and sucrose metabolism	4
hsa00030	Pentose phosphate pathway	4
hsa00520	Amino sugar and nucleotide sugar metabolism	3
hsa00052	Galactose metabolism	3
hsa01200	Carbon metabolism	3
hsa00524	Neomycin, kanamycin and gentamicin biosynthesis	1
hsa00562	Inositol phosphate metabolism	1
hsa01100	Metabolic pathways	1
hsa01250	Biosynthesis of nucleotide sugars	1
hsa00480	Glutathione metabolism	1