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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:N-acetyl-L-cysteinate
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Accession:CHEBI:78236 term browser browse the term
Definition:A monocarboxylic acid anion that is the conjugate base of N-acetyl-L-cysteine, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Synonyms:exact_synonym: (2R)-2-acetamido-3-sulfanylpropanoate
 related_synonym: Formula=C5H8NO3S;   InChI=1S/C5H9NO3S/c1-3(7)6-4(2-10)5(8)9/h4,10H,2H2,1H3,(H,6,7)(H,8,9)/p-1/t4-/m0/s1;   InChIKey=PWKSKIMOESPYIA-BYPYZUCNSA-M;   N-acetyl-L-cysteine;   SMILES=CC(=O)N[C@@H](CS)C([O-])=O
 xref: MetaCyc:CPD-9175;   PMID:19268377;   Reaxys:6327823
 cyclic_relationship: is_conjugate_base_of CHEBI:28939


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Path 1
Term Annotations click to browse term
  CHEBI ontology 26041
    role 25957
      chemical role 24249
        antioxidant 17501
          N-acetyl-L-cysteinate 0
            S-substituted N-acetyl-L-cysteinate + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26041
    subatomic particle 26016
      composite particle 26016
        hadron 26016
          baryon 26016
            nucleon 26016
              atomic nucleus 26016
                atom 26016
                  main group element atom 25841
                    p-block element atom 25841
                      carbon group element atom 25441
                        carbon atom 25399
                          organic molecular entity 25399
                            organic ion 10241
                              organic anion 3769
                                carboxylic acid anion 2558
                                  monocarboxylic acid anion 1661
                                    N-acetyl-L-cysteinate 0
                                      S-substituted N-acetyl-L-cysteinate + 0
paths to the root