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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:2-methoxyacetaminophen glucuronide
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Accession:CHEBI:133005 term browser browse the term
Definition:A beta-D-glucosiduronic acid that is 2-methoxyacetaminophen in which the phenolic hydrogen is replaced by a beta-D-glucuronosyl group.
Synonyms:exact_synonym: 4-acetamido-3-methoxyphenyl beta-D-glucopyranosiduronic acid
 related_synonym: 2-methoxyacetaminophen O-beta-D-glucosiduronic acid;   2-methoxyacetaminophen beta-D-glucuronide;   Formula=C15H19NO9;   InChI=1S/C15H19NO9/c1-6(17)16-8-4-3-7(5-9(8)23-2)24-15-12(20)10(18)11(19)13(25-15)14(21)22/h3-5,10-13,15,18-20H,1-2H3,(H,16,17)(H,21,22)/t10-,11-,12+,13-,15+/m0/s1;   InChIKey=GDCCQRYSPGZVPX-DKBOKBLXSA-N;   SMILES=C=1(O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(O)=O)O)O)O)C=CC(=C(C1)OC)NC(C)=O
 xref: PMID:4850385
 cyclic_relationship: is_conjugate_acid_of CHEBI:133006


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Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        xenobiotic 0
          paracetamol 0
            2-methoxyacetaminophen 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
                    main group molecular entity 0
                      s-block molecular entity 0
                        hydrogen molecular entity 0
                          hydrides 0
                            inorganic hydride 0
                              pnictogen hydride 0
                                nitrogen hydride 0
                                  azane 0
                                    ammonia 0
                                      organic amino compound 0
                                        aromatic amine 0
                                          anilines 0
                                            substituted aniline 0
                                              aminophenol 0
                                                4-aminophenol 0
                                                  paracetamol 0
                                                    2-methoxyacetaminophen glucuronide 0
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