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CHEBI:17907 - styrene oxide

ChEBI IDCHEBI:17907
ChEBI Namestyrene oxide
Stars
DefinitionAn epoxide that is oxirane in which one of the hydrogens has been replaced by a phenyl group.
Secondary ChEBI IDsCHEBI:9298, CHEBI:15124, CHEBI:26798
Last Modified21 August 2017
DownloadsMolfile
FormulaC8H8O
Net Charge0
Average Mass120.151
Monoisotopic Mass120.05751
SMILESc1ccc(C2CO2)cc1
InChIInChI=1S/C8H8O/c1-2-4-7(5-3-1)8-6-9-8/h1-5,8H,6H2
InChIKeyAWMVMTVKBNGEAK-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
styrene oxide (CHEBI:17907) has parent hydride styrene (CHEBI:27452)
styrene oxide (CHEBI:17907) has role human xenobiotic metabolite (CHEBI:76967)
styrene oxide (CHEBI:17907) is a epoxide (CHEBI:32955)
Incoming Relation(s)
(R)-styrene oxide (CHEBI:45389) is a styrene oxide (CHEBI:17907)
(S)-styrene oxide (CHEBI:51014) is a styrene oxide (CHEBI:17907)
IUPAC Name 
2-phenyloxirane
Synonyms  Source
1,2-epoxy-1-phenylethaneChemIDplus
1,2-epoxyethylbenzeneChemIDplus
1-phenyl-1,2-epoxyethaneChemIDplus
1-phenyloxiraneChemIDplus
(epoxyethyl)benzeneNIST Chemistry WebBook
epoxyethylbenzeneChemIDplus
UniProt Name  Source
styrene oxideUniProt
Manual XrefsDatabases
2-PhenyloxiraneMetaCyc
c0037UM-BBD
C02083KEGG COMPOUND
Styrene_oxideWikipedia
Registry NumbersSources
Reaxys:108582Reaxys
Gmelin:50213Gmelin
CAS:96-09-3ChemIDplus
CAS:96-09-3NIST Chemistry WebBook
CAS:96-09-3KEGG COMPOUND
Citations