CHEBI:88704 - 4-Hydroxy-5-(phenyl)-valeric acid-O-glucuronide

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ChEBI Name 4-Hydroxy-5-(phenyl)-valeric acid-O-glucuronide ChEBI ID CHEBI:88704 Stars This entity has been manually annotated by a third party. Supplier Information No supplier information found for this compound. Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C17H22O9 Net Charge 0 Average Mass 370.352 Monoisotopic Mass 370.12638 InChI InChI=1S/C17H22O9/c18-10(8-9-4-2-1-3-5-9)6-7-11(19)25-17-14(22)12(20)13(21)15(26-17)16(23)24/h1-5,10,12-15,17-18,20-22H,6-8H2,(H,23,24)/t10?,12-,13-,14+,15-,17?/m1/s1 InChIKey IMTGYVWDOAJQQP-UFZVYEDBSA-N SMILES C=1C=C(C=CC1)CC(CCC(OC2O[C@H]([C@@H]([C@H]([C@@H]2O)O)O)C(=O)O)=O)O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed ChEBI Ontology Outgoing 4-Hydroxy-5-(phenyl)-valeric acid-O-glucuronide (CHEBI:88704) is a O-acyl carbohydrate (CHEBI:52782) 4-Hydroxy-5-(phenyl)-valeric acid-O-glucuronide (CHEBI:88704) is a fatty acid derivative (CHEBI:61697) Synonym Source (2R,3R,4R,5S)-3,4,5-trihydroxy-6-[(4-hydroxy-5-phenylpentanoyl)oxy]oxane-2-carboxylic acid HMDB Manual Xref Database HMDB0059980 HMDB View more database links Citation Type Source 22827565 PubMed citation Europe PMC