CHEBI:178081 - 2-ethylphenylsulfate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-ethylphenylsulfate
ChEBI ID CHEBI:178081
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H18O4S
Net Charge 0
Average Mass 306.380
Monoisotopic Mass 306.09258
InChI InChI=1S/C16H18O4S/c1-3-13-9-5-7-11-15(13)19-21(17,18)20-16-12-8-6-10-14(16)4-2/h5-12H,3-4H2,1-2H3
InChIKey VYHOQNBQODHWTB-UHFFFAOYSA-N
SMILES S(OC=1C(CC)=CC=CC1)(OC=2C(CC)=CC=CC2)(=O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing 2-ethylphenylsulfate (CHEBI:178081) is a sulfur molecular entity (CHEBI:26835)
IUPAC Name
bis(2-ethylphenyl) sulate
Manual Xref Database
67492277 ChemSpider
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