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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-hydroxy-4-methyl-L-kynurenine zwitterion
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Accession:CHEBI:141609 term browser browse the term
Definition:Zwitterionic form of 3-hydroxy-4-methyl-L-kynurenine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3
Synonyms:related_synonym: 3-hydroxy-4-methyl-L-kynurenine;   Formula=C11H14N2O4;   InChI=1S/C11H14N2O4/c1-5-2-3-6(9(13)10(5)15)8(14)4-7(12)11(16)17/h2-3,7,15H,4,12-13H2,1H3,(H,16,17)/t7-/m0/s1;   InChIKey=BHPWCYYINLFUDE-ZETCQYMHSA-N;   L-3H4MK;   SMILES=C1(C(C[C@@H](C(=O)[O-])[NH3+])=O)=CC=C(C(=C1N)O)C
 xref: MetaCyc:CPD-18908;   PMID:21612226
 cyclic_relationship: is_enantiomer_of CHEBI:141611

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  CHEBI ontology 0
    chemical entity 0
      molecular entity 0
        polyatomic entity 0
          molecule 0
            organic molecule 0
              dipolar compound 0
                zwitterion 0
                  amino acid zwitterion 0
                    3-hydroxy-4-methyl-L-kynurenine zwitterion 0
Path 2
Term Annotations click to browse term
  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
                            organic molecule 0
                              dipolar compound 0
                                zwitterion 0
                                  amino acid zwitterion 0
                                    L-kynurenine zwitterion 0
                                      3-hydroxy-4-methyl-L-kynurenine zwitterion 0
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