CHEBI:34372 - 4,4'-sulfonyldiphenol

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ChEBI Name 4,4'-sulfonyldiphenol
ChEBI ID CHEBI:34372
Definition A sulfone that is diphenyl sulfone in which both of the para hydrogens have been replaced by hydroxy groups.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C12H10O4S
Net Charge 0
Average Mass 250.27000
Monoisotopic Mass 250.030
InChI InChI=1S/C12H10O4S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8,13-14H
InChIKey VPWNQTHUCYMVMZ-UHFFFAOYSA-N
SMILES Oc1ccc(cc1)S(=O)(=O)c1ccc(O)cc1
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): endocrine disruptor
Any compound that can disrupt the functions of the endocrine (hormone) system
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ChEBI Ontology
Outgoing 4,4'-sulfonyldiphenol (CHEBI:34372) has functional parent diphenyl sulfone (CHEBI:78360)
4,4'-sulfonyldiphenol (CHEBI:34372) has role endocrine disruptor (CHEBI:138015)
4,4'-sulfonyldiphenol (CHEBI:34372) has role metabolite (CHEBI:25212)
4,4'-sulfonyldiphenol (CHEBI:34372) is a bisphenol (CHEBI:22901)
4,4'-sulfonyldiphenol (CHEBI:34372) is a sulfone (CHEBI:35850)
IUPAC Name
4,4'-sulfonyldiphenol
Synonyms Sources
1,1'-Sulfonylbis(4-hydroxybenzene) KEGG COMPOUND
4,4'-Dihydroxydiphenyl sulfone ChemIDplus
Bis(4-hydroxyphenyl) sulfone ChemIDplus
Bis(p-hydroxyphenyl) sulfone ChemIDplus
Bisphenol S KEGG COMPOUND
DHDPhS ChEBI
Manual Xrefs Databases
Bisphenol_S Wikipedia
C14216 KEGG COMPOUND
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Registry Numbers Types Sources
2052954 Reaxys Registry Number Reaxys
80-09-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
26 July 2017