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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(alpha)-(L-gamma-glutamyl)-hercynyl-L-cysteine sulfoxide
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Accession:CHEBI:83290 term browser browse the term
Definition:A non-proteinogenic dipeptide formed from L-gamma-glutamic acid and hercynyl-L-cysteine sulfoxide residues. It is an intermediate in the synthesis of ergothioneine, a compound found in certain fungi and mycobacteria.
Synonyms:exact_synonym: L-gamma-glutamyl-3-({4-[(2S)-2-carboxylato-2-(trimethylazaniumyl)ethyl]-1H-imidazol-2-yl}sulfinyl)-L-alanine
 related_synonym: Formula=C17H27N5O8S;   InChI=1S/C17H27N5O8S/c1-22(2,3)12(16(28)29)6-9-7-19-17(20-9)31(30)8-11(15(26)27)21-13(23)5-4-10(18)14(24)25/h7,10-12H,4-6,8,18H2,1-3H3,(H4-,19,20,21,23,24,25,26,27,28,29)/t10-,11-,12-,31?/m0/s1;   InChIKey=SJHLSLUUWIBQNS-TYLCEOGASA-N;   SMILES=C[N+](C)(C)[C@@H](Cc1c[nH]c(n1)S(=O)C[C@H](NC(=O)CC[C@H](N)C(O)=O)C(O)=O)C([O-])=O
 xref: MetaCyc:CPD-15279;   Reaxys:24604970
 cyclic_relationship: is_conjugate_acid_of CHEBI:82703


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  CHEBI ontology 392
    role 392
      application 346
        food additive 31
          flour treatment agent 13
            L-cysteine 5
              N(alpha)-(L-gamma-glutamyl)-hercynyl-L-cysteine sulfoxide 0
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  CHEBI ontology 392
    subatomic particle 392
      composite particle 392
        hadron 392
          baryon 392
            nucleon 392
              atomic nucleus 392
                atom 392
                  main group element atom 385
                    p-block element atom 385
                      carbon group element atom 374
                        carbon atom 373
                          organic molecular entity 373
                            organic group 309
                              organic divalent group 308
                                organodiyl group 308
                                  carbonyl group 308
                                    carbonyl compound 308
                                      carboxylic acid 273
                                        carboacyl group 212
                                          univalent carboacyl group 212
                                            carbamoyl group 210
                                              carboxamide 210
                                                peptide 20
                                                  oligopeptide 16
                                                    dipeptide 9
                                                      N(alpha)-(L-gamma-glutamyl)-hercynyl-L-cysteine sulfoxide 0
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