RefMet Compound Details

MW structure38172 (View MW Metabolite Database details)
RefMet namesn-Glycero-2-phosphate
Systematic name[(1,3-dihydroxypropan-2-yl)oxy]phosphonic acid
SMILESOP(O)(=O)OC(CO)CO
Exact mass172.013678 (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
FormulaC3H9O6PView other entries in RefMet with this formula
InChIInChI=1S/C3H9O6P/c4-1-3(2-5)9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)
InChIKeyDHCLVCXQIBBOPH-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassPhosphate esters
Sub ClassMonoalkyl phosphates
Pubchem CID2526
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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