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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:Benzoyl glucuronide (Benzoic acid)
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Accession:CHEBI:168513 term browser browse the term
Synonyms:exact_synonym: (2S,3S,4S,5R,6S)-6-benzoyloxy-3,4,5-trihydroxyoxane-2-carboxylic acid
 related_synonym: Formula=C13H14O8;   InChI=1S/C13H14O8/c14-7-8(15)10(11(17)18)20-13(9(7)16)21-12(19)6-4-2-1-3-5-6/h1-5,7-10,13-16H,(H,17,18)/t7-,8-,9+,10-,13-/m0/s1;   InChIKey=NLOPFVNXNMEEDI-UNLLLRGISA-N;   SMILES=O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC(=O)C2=CC=CC=C2)C(O)=O
 xref: CAS:19237-53-7;   Chemspider:103031;   HMDB:HMDB0010324


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19893
    role 19863
      chemical role 19493
        donor 18941
          Bronsted acid 18821
            oxoacid 18794
              carbon oxoacid 18668
                carboxylic acid 18665
                  carbohydrate acid 938
                    carbohydrate acid derivative 209
                      glucosiduronic acid 201
                        Benzoyl glucuronide (Benzoic acid) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19893
    subatomic particle 19891
      composite particle 19891
        hadron 19891
          baryon 19891
            nucleon 19891
              atomic nucleus 19891
                atom 19891
                  main group element atom 19830
                    p-block element atom 19830
                      carbon group element atom 19771
                        carbon atom 19767
                          organic molecular entity 19767
                            heteroorganic entity 19525
                              organochalcogen compound 19286
                                organooxygen compound 19202
                                  carbohydrates and carbohydrate derivatives 15304
                                    carbohydrate 15304
                                      carbohydrate derivative 14320
                                        glycosyl compound 13082
                                          glycoside 11852
                                            glycosiduronic acid 201
                                              glucosiduronic acid 201
                                                Benzoyl glucuronide (Benzoic acid) 0
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