RefMet Compound Details

RefMet IDRM0188078
MW structure206784 (View MW Metabolite Database details)
RefMet nameS-(2-Carboxyethyl)cysteine
Systematic name(2R)-2-amino-3-(2-carboxyethylsulfanyl)propanoic acid
SMILESC(CSC[C@@H](C(=O)O)N)C(=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass193.040881 (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
FormulaC6H11NO4SView other entries in RefMet with this formula
InChI
InChIKeyFBPINGSGHKXIQA-BYPYZUCNSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassAmino acids
Pubchem CID23618202
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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