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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-indole carboxylic acid glucuronide
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Accession:CHEBI:68486 term browser browse the term
Definition:An O-acyl carbohydrate obtained by formal condensation of the carboxy group of indole-3-carboxylic acid with the anomeric hydroxy group of beta-D-glucuronic acid.
Synonyms:exact_synonym: 1-O-(1H-indol-3-ylcarbonyl)-beta-D-glucopyranuronic acid
 related_synonym: Formula=C15H15NO8;   InChI=1S/C15H15NO8/c17-9-10(18)12(13(20)21)23-15(11(9)19)24-14(22)7-5-16-8-4-2-1-3-6(7)8/h1-5,9-12,15-19H,(H,20,21)/t9-,10-,11+,12?,15-/m0/s1;   InChIKey=BDNWJTRKUBXAGH-HJHSNUOESA-N;   SMILES=C1=CC=C2C(=C1)C(=CN2)C(O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(O)=O)O)O)O)=O
 xref: HMDB:HMDB0013189;   PMID:22770225


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Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            3-indole carboxylic acid glucuronide 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
                                        uronic acid 0
                                          hexuronic acid 0
                                            glucuronic acids 0
                                              glucuronic acid 0
                                                D-glucuronic acid 0
                                                  D-glucopyranuronic acid 0
                                                    beta-D-glucuronic acid 0
                                                      3-indole carboxylic acid glucuronide 0
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