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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:indole-3-butyric acid
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Accession:CHEBI:33070 term browser browse the term
Definition:A indol-3-yl carboxylic acid that is butanoic acid carrying a 1H-indol-3-yl substituent at position 1.
Synonyms:exact_synonym: 4-(1H-indol-3-yl)butanoic acid
 related_synonym: 1H-indole-3-butanoic acid;   3-INDOLEBUTYRIC ACID;   3-indolyl-gamma-butyric acid;   4-(indol-3-yl)butyric acid;   4-indol-3-ylbutyric acid;   Formula=C12H13NO2;   IBA;   InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15);   InChIKey=JTEDVYBZBROSJT-UHFFFAOYSA-N;   Indolebutyric acid;   SMILES=OC(=O)CCCc1c[nH]c2ccccc12;   Seradix;   indole-3-butanoic acid
 alt_id: CHEBI:24806;   CHEBI:39986;   CHEBI:5914
 xref: BPDB:1465;   Beilstein:171120;   CAS:133-32-4;   DrugBank:DB02740;   Gmelin:143637;   HMDB:HMDB0002096;   KEGG:C11284;   KNApSAcK:C00000116
 xref_mesh: MESH:C014612
 xref: PDBeChem:3IB;   PMID:23201417;   PMID:23795714;   Reaxys:171120;   Wikipedia:Indole-3-butyric_acid
 cyclic_relationship: is_conjugate_acid_of CHEBI:143274

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Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        molecular messenger 0
          hormone 0
            plant hormone 0
              indole-3-butyric acid 0
                4-(indol-3-yl)butanoyl-beta-D-glucose 0
                N(2)-[4-(indol-3-yl)butanoyl]-L-glutamine 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
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      monocarboxylic acid 0
                                        fatty acid 0
                                          short-chain fatty acid 0
                                            fatty acid 4:0 0
                                              butyric acid 0
                                                indole-3-butyric acid 0
                                                  4-(indol-3-yl)butanoyl-beta-D-glucose 0
                                                  N(2)-[4-(indol-3-yl)butanoyl]-L-glutamine 0
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