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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:5-hydroxybisphenol A
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Accession:CHEBI:31133 term browser browse the term
Definition:A bisphenol (methylenediphenol) having hydroxy functions at C-3, C-4 and C-4', and gem-dimethyl groups on the methylene bridge.
Synonyms:exact_synonym: 4-[2-(4-hydroxyphenyl)propan-2-yl]benzene-1,2-diol
 related_synonym: 4-[1-(4-hydroxyphenyl)-1-methylethyl]benzene-1,2-diol;   5-Hydroxybisphenol;   BPAcatechol;   Formula=C15H16O3;   InChI=1S/C15H16O3/c1-15(2,10-3-6-12(16)7-4-10)11-5-8-13(17)14(18)9-11/h3-9,16-18H,1-2H3;   InChIKey=YGFAMQHMUSBLBC-UHFFFAOYSA-N;   SMILES=CC(C)(c1ccc(O)cc1)c1ccc(O)c(O)c1;   catechol-BPA
 xref: CAS:79371-66-7;   KEGG:C13626



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Path 1
Term Annotations click to browse term
  CHEBI ontology 19757
    role 19730
      biological role 19728
        xenobiotic 18621
          bisphenol A 17712
            5-hydroxybisphenol A 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19757
    subatomic particle 19755
      composite particle 19755
        hadron 19755
          baryon 19755
            nucleon 19755
              atomic nucleus 19755
                atom 19755
                  main group element atom 19703
                    p-block element atom 19703
                      carbon group element atom 19649
                        carbon atom 19645
                          organic molecular entity 19645
                            organic molecule 19604
                              organic cyclic compound 19407
                                organic aromatic compound 19273
                                  phenols 18571
                                    bisphenol 17849
                                      bisphenol A 17712
                                        5-hydroxybisphenol A 0
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