RefMet Compound Details

MW structure51369 (View MW Metabolite Database details)
RefMet name3,6-Anhydro-glucose
Systematic name(2R)-2-[(2S,3R,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetaldehyde
SMILESC(=O)[C@@H]([C@@H]1[C@@H]([C@@H](CO1)O)O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass162.052825 (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
FormulaC6H10O5View other entries in RefMet with this formula
InChIInChI=1S/C6H10O5/c7-1-3(8)6-5(10)4(9)2-11-6/h1,3-6,8-10H,2H2/t3-,4+,5+,6+/m0/s1
InChIKeyWZYRMLAWNVOIEX-SLPGGIOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassCarbohydrates
Main ClassMonosaccharides
Sub ClassHexoses
Pubchem CID16069993
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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