RefMet Compound Details

MW structure37376 (View MW Metabolite Database details)
RefMet nameIsoxanthopterin
Systematic name2-amino-1,4,7,8-tetrahydropteridine-4,7-dione
SMILESc1c(nc2c(c(nc(N)n2)O)n1)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass179.044325 (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
FormulaC6H5N5O2View other entries in RefMet with this formula
InChIKeyGLKCOBIIZKYKFN-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganoheterocyclic compounds
Main ClassPterins
Sub ClassPterins
Pubchem CID135398700
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)