CHEBI:89553 - trans-isoeugenol-O-glucuronide

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ChEBI Name trans-isoeugenol-O-glucuronide ChEBI ID CHEBI:89553 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 C16H20O8 Net Charge 0 Average Mass 340.326 Monoisotopic Mass 340.11582 InChI InChI=1S/C16H20O8/c1-3-4-8-5-6-9(10(7-8)22-2)23-16-13(19)11(17)12(18)14(24-16)15(20)21/h3-7,11-14,16-19H,1-2H3,(H,20,21)/b4-3+/t11-,12-,13+,14-,16?/m0/s1 InChIKey HBQGHTRBYUFZLV-MIJQFFSFSA-N SMILES COC1=CC(/C=C/C)=CC=C1OC2[C@@H]([C@H]([C@@H]([C@H](O2)C(O)=O)O)O)O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed ChEBI Ontology Outgoing trans-isoeugenol-O-glucuronide (CHEBI:89553) is a glucosiduronic acid (CHEBI:24302) Synonym Source (2S,3S,4S,5R)-3,4,5-trihydroxy-6-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}oxane-2-carboxylic acid HMDB Manual Xref Database HMDB0060021 HMDB View more database links Citation Type Source 22827565 PubMed citation Europe PMC