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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-(indol-3-yl)lactic acid
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Accession:CHEBI:24813 term browser browse the term
Definition:A hydroxy monocarboxylic acid that is lactic acid substituted by a 1H-indol-3-yl group at position 3. It is a metabolite of tryptophan.
Synonyms:related_synonym: 2-hydroxy-3-(1H-indol-3-yl)propanoic acid;   Formula=C11H11NO3;   InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15);   InChIKey=XGILAAMKEQUXLS-UHFFFAOYSA-N;   SMILES=OC(Cc1c[nH]c2ccccc12)C(O)=O;   alpha-Hydroxy-1H-indole-3-propanoic acid;   indole-3-lactic acid
 xref: Beilstein:86202;   CAS:1821-52-9;   HMDB:HMDB0000671;   KEGG:C02043
 xref_mesh: MESH:C024139
 xref: MetaCyc:INDOLE_LACTATE;   PMID:16347781;   PMID:20540569;   PMID:21749142;   PMID:22372405;   PMID:23111785;   PMID:2361979;   PMID:23924721;   PMID:533277;   Reaxys:86202
 cyclic_relationship: is_conjugate_acid_of CHEBI:17282


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  CHEBI ontology 0
    chemical entity 0
      chemical substance 0
        mixture 0
          racemate 0
            rac-lactic acid 0
              3-(indol-3-yl)lactic acid 0
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  CHEBI ontology 0
    subatomic particle 0
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        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
                                              2-hydroxypropanoic acid 0
                                                (R)-lactic acid 0
                                                  rac-lactic acid 0
                                                    3-(indol-3-yl)lactic acid 0
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