CHEBI:133460 - guaiacol sulfate

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ChEBI Name guaiacol sulfate ChEBI ID CHEBI:133460 Definition An aryl sulfate that is catechol in which the two phenolic hydrogens are replaced by methyl and sulfo groups. 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 C7H8O5S Net Charge 0 Average Mass 204.202 Monoisotopic Mass 204.00924 InChI InChI=1S/C7H8O5S/c1-11-6-4-2-3-5-7(6)12-13(8,9)10/h2-5H,1H3,(H,8,9,10) InChIKey AQTYXAPIHMXAAV-UHFFFAOYSA-N SMILES C=1C=CC=C(C1OC)OS(O)(=O)=O ChEBI Ontology Outgoing guaiacol sulfate (CHEBI:133460) has functional parent catechol (CHEBI:18135) guaiacol sulfate (CHEBI:133460) is a aryl sulfate (CHEBI:37919) guaiacol sulfate (CHEBI:133460) is a monomethoxybenzene (CHEBI:25235) guaiacol sulfate (CHEBI:133460) is conjugate acid of guaiacol sulfate(1−) (CHEBI:133463) Incoming guaiacol sulfate(1−) (CHEBI:133463) is conjugate base of guaiacol sulfate (CHEBI:133460) IUPAC Name 2-methoxyphenyl hydrogen sulfate Synonyms Sources 2-Methoxyphenyl sulfate ChemIDplus o-methoxyphenyl hydrogen sulfate ChEBI o-Methoxyphenyl sulfate ChemIDplus O-methylcatechol hydrogen sulfate ChEBI O-methylcatechol sulfate ChEBI Manual Xref Database HMDB0060013 HMDB View more database links Registry Numbers Types Sources 2455916 Reaxys Registry Number Reaxys 3233-59-8 CAS Registry Number ChemIDplus Citation Type Source 13705637 PubMed citation Europe PMC Last Modified 28 September 2016