RefMet Compound Details

MW structure67391 (View MW Metabolite Database details)
RefMet nameHexose 6-phosphate
Systematic name(3,4,5,6-tetrahydroxytetrahydropyran-2-yl)methyl dihydrogen phosphate
SMILESC(C1C(C(C(C(O)O1)O)O)O)OP(=O)(O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass260.029723 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC6H13O9PView other entries in RefMet with this formula
InChIInChI=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)
InChIKeyNBSCHQHZLSJFNQ-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassCarbohydrates
Main ClassMonosaccharides
Sub ClassMonosaccharide phosphates
Pubchem CID208
Annotation level2   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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