CHEBI:31133 - 5-hydroxybisphenol A

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ChEBI Name 5-hydroxybisphenol A ChEBI ID CHEBI:31133 Definition A bisphenol (methylenediphenol) having hydroxy functions at C-3, C-4 and C-4', and gem-dimethyl groups on the methylene bridge. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C15H16O3 Net Charge 0 Average Mass 244.28574 Monoisotopic Mass 244.10994 InChI 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 ChEBI Ontology Outgoing 5-hydroxybisphenol A (CHEBI:31133) has functional parent bisphenol A (CHEBI:33216) 5-hydroxybisphenol A (CHEBI:31133) is a bisphenol (CHEBI:22901) IUPAC Name 4-[2-(4-hydroxyphenyl)propan-2-yl]benzene-1,2-diol Synonyms Sources 4-[1-(4-hydroxyphenyl)-1-methylethyl]benzene-1,2-diol IUPAC 5-Hydroxybisphenol KEGG COMPOUND 5-Hydroxybisphenol KEGG COMPOUND 5-Hydroxybisphenol A KEGG COMPOUND BPA catechol ChEBI BPAcatechol KEGG COMPOUND catechol-BPA ChEBI Manual Xref Database C13626 KEGG COMPOUND View more database links Registry Number Type Source 79371-66-7 CAS Registry Number KEGG COMPOUND Last Modified 28 July 2014