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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:3-amino-N-(trans-3-carbamoyloxirane-2-carbonyl)-L-alanine
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Accession:CHEBI:85509 term browser browse the term
Definition:A dicarboxylic acid diamide consisting of 3-aminoalanine in which the alpha-amino fuunction is acylated by a 3-carbamoyloxirane-2-carbonyl group. NB Although the relative configuration of the epoxide moiety has been assigned as trans, it has not yet been established whether the absolute configuration is R,R (as drawn) or S,S.
Synonyms:exact_synonym: 3-amino-N-[(2R*,3R*)-3-carbamoyloxirane-2-carbonyl]-L-alanine
 related_synonym: Formula=C7H11N3O5;   InChI=1S/C7H11N3O5/c8-1-2(7(13)14)10-6(12)4-3(15-4)5(9)11/h2-4H,1,8H2,(H2,9,11)(H,10,12)(H,13,14)/t2-,3+,4+/m0/s1;   InChIKey=NEROFFUGAIRXGM-PZGQECOJSA-N;   SMILES=NC[C@H](NC(=O)[C@@H]1O[C@H]1C(N)=O)C(O)=O
 xref: MetaCyc:CPD-17545
 cyclic_relationship: is_tautomer_of CHEBI:84913

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  CHEBI ontology 0
    role 0
      application 0
        food additive 0
          food acidity regulator 0
            fumaric acid 0
              3-amino-N-(trans-3-carbamoyloxirane-2-carbonyl)-L-alanine 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      monocarboxylic acid 0
                                        fatty acid 0
                                          saturated fatty acid 0
                                            propionic acid 0
                                              alanine 0
                                                alanine derivative 0
                                                  3-aminoalanine 0
                                                    3-amino-L-alanine 0
                                                      3-amino-N-(trans-3-carbamoyloxirane-2-carbonyl)-L-alanine 0
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