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ONTOLOGY REPORT - ANNOTATIONS


Term:1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate)-beta-D-Glucopyranuronic acid
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Accession:CHEBI:88735 term browser browse the term
Definition:A terpene glycoside that has formula C19H26O8.
Synonyms:related_synonym: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-({2-[4-(2-methylpropyl)phenyl]propanoyl}oxy)oxane-2-carboxylic acid;   (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-[4-(2-methylpropyl)phenyl]propanoyloxy]oxane-2-carboxylic acid;   1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate) b-D-Glucopyranuronic acid;   1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate) b-delta-Glucopyranuronic acid;   1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate) beta-delta-Glucopyranuronic acid;   Formula=C19H26O8;   Ibuprofen acyl glucuronide;   Ibuprofen acyl-beta-D-glucuronide;   InChI=1S/C19H26O8/c1-9(2)8-11-4-6-12(7-5-11)10(3)18(25)27-19-15(22)13(20)14(21)16(26-19)17(23)24/h4-7,9-10,13-16,19-22H,8H2,1-3H3,(H,23,24)/t10?,13-,14-,15+,16-,19-/m0/s1;   InChIKey=ABOLXXZAJIAUGR-JPMMFUSZSA-N;   SMILES=O1[C@@H](OC(=O)C(C2=CC=C(CC(C)C)C=C2)C)[C@H](O)[C@@H](O)[C@H](O)[C@H]1C(O)=O
 xref: CAS:115075-59-7;   HMDB:HMDB0010343
 xref_mesh: MESH:C081281
 xref: MetaCyc:Beta-D-Glucuronides;   PMID:7587932;   PMID:7781263;   PMID:8496270


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1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate)-beta-D-Glucopyranuronic acid term browser
Symbol Object Name JBrowse Chr Start Stop Reference
G Il1a interleukin 1 alpha JBrowse link 3 121,824,712 121,836,122 RGD:6480464

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19790
    chemical entity 19789
      atom 19788
        nonmetal atom 19662
          carbon atom 19561
            organic molecular entity 19561
              isoprenoid 9508
                terpenoid 9503
                  terpene glycoside 369
                    1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate)-beta-D-Glucopyranuronic acid 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19790
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19674
                    p-block element atom 19674
                      carbon group element atom 19572
                        carbon atom 19561
                          organic molecular entity 19561
                            heteroorganic entity 19158
                              organochalcogen compound 18859
                                organooxygen compound 18776
                                  carbohydrates and carbohydrate derivatives 12164
                                    carbohydrate 12164
                                      carbohydrate derivative 11789
                                        glycosyl compound 10825
                                          glycoside 9177
                                            terpene glycoside 369
                                              1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate)-beta-D-Glucopyranuronic acid 1
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