CHEBI:88405 - Homovanillic acid sulfate

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ChEBI Name Homovanillic acid sulfate ChEBI ID CHEBI:88405 Stars This entity has been manually annotated by a third party. 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 C9H10O7S Net Charge 0 Average Mass 262.238 Monoisotopic Mass 262.01472 InChI InChI=1S/C9H10O7S/c1-15-8-4-6(5-9(10)11)2-3-7(8)16-17(12,13)14/h2-4H,5H2,1H3,(H,10,11)(H,12,13,14) InChIKey IACOAKYXFIWAQN-UHFFFAOYSA-N SMILES S(=O)(=O)(OC=1C(=CC(=CC1)CC(O)=O)OC)O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed ChEBI Ontology Outgoing Homovanillic acid sulfate (CHEBI:88405) is a alcohol (CHEBI:30879) Homovanillic acid sulfate (CHEBI:88405) is a phenols (CHEBI:33853) Synonyms Sources 2-[3-methoxy-4-(sulfooxy)phenyl]acetic acid HMDB 3-Methoxy-4-(sulfooxy)-benzeneacetic acid HMDB 4-Sulfooxy-3-methoxy-benzeneacetic acid HMDB 4-Sulfooxy-3-methoxyphenylacetic acid HMDB Manual Xref Database HMDB0011719 HMDB View more database links Registry Number Type Source 38339-06-9 CAS Registry Number KEGG COMPOUND Citation Type Source 22827565 PubMed citation Europe PMC