CHEBI:183269 - 1-Phenyl-1,2-ethanediol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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ChEBI Name 1-Phenyl-1,2-ethanediol
ChEBI ID CHEBI:183269
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H10O2
Net Charge 0
Average Mass 138.166
Monoisotopic Mass 138.06808
InChI InChI=1S/C8H10O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8-10H,6H2
InChIKey PWMWNFMRSKOCEY-UHFFFAOYSA-N
SMILES OC(C1=CC=CC=C1)CO
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing 1-Phenyl-1,2-ethanediol (CHEBI:183269) is a benzenes (CHEBI:22712)
IUPAC Name
1-phenylethane-1,2-diol
Manual Xref Database
6882 ChemSpider
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Registry Number Type Source
93-56-1 CAS Registry Number ChemIDplus