RefMet Compound Details

RefMet IDRM0130509
MW structure78971 (View MW Metabolite Database details)
RefMet nameSer-Ser   Species distribution   Sample source distribution
Systematic nameL-Seryl-L-serine
SMILESC([C@@H](C(=O)N[C@@H](CO)C(=O)O)N)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass192.074623 (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
FormulaC6H12N2O5View other entries in RefMet with this formula
InChIInChI=1S/C6H12N2O5/c7-3(1-9)5(11)8-4(2-10)6(12)13/h3-4,9-10H,1-2,7H2,(H,8,11)(H,12,13)/t3-,4-/m0/s1
InChIKeyXZKQVQKUZMAADP-IMJSIDKUSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassDipeptides
Pubchem CID7019105
ChEBI ID73653
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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