RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet IDRM0136376
RefMet nameL-Canaline
Systematic name(2S)-2-amino-4-(aminooxy)butanoic acid
SynonymsPubChem Synonyms
Exact mass134.069143 (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
FormulaC4H10N2O3View other entries in RefMet with this formula
Molecular descriptors
Molfile41949 (Download molfile/View MW Metabolite Database details)
InChIInChI=1S/C4H10N2O3/c5-3(4(7)8)1-2-9-6/h3H,1-2,5-6H2,(H,7,8)/t3-/m0/s1
InChIKeyFQPGMQABJNQLLF-VKHMYHEASA-NView other enantiomers/diastereomers of this metabolite in RefMet
SMILESC(CON)[C@@H](C(=O)O)N
Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassAmino acids
Distribution of L-Canaline in NMDR studies
SpeciesPlot Species distribution
Sample sourcePlot Sample source(tissue) distribution
StudiesNMDR Studies reporting L-Canaline
External Links
Pubchem CID441443
ChEBI ID41401
KEGG IDC08270
HMDB IDHMDB0012251
Chemspider ID390176
MetaCyc IDL-CANALINE
Structural annotation level
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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