CHEBI:87248 - ethyl glucuronide

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ChEBI Name ethyl glucuronide ChEBI ID CHEBI:87248 Definition A β-D-glucosiduronic acid that is the ethyl derivative of β-D-glucuronic acid. 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 C8H14O7 Net Charge 0 Average Mass 222.19260 Monoisotopic Mass 222.07395 InChI InChI=1S/C8H14O7/c1-2-14-8-5(11)3(9)4(10)6(15-8)7(12)13/h3-6,8-11H,2H2,1H3,(H,12,13)/t3-,4-,5+,6-,8+/m0/s1 InChIKey IWJBVMJWSPZNJH-UQGZVRACSA-N SMILES CCO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O Roles Classification Biological Role(s): human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. View more via ChEBI Ontology ChEBI Ontology Outgoing ethyl glucuronide (CHEBI:87248) has role human urinary metabolite (CHEBI:84087) ethyl glucuronide (CHEBI:87248) is a β-D-glucosiduronic acid (CHEBI:15341) IUPAC Name ethyl β-D-glucopyranosiduronic acid Manual Xref Database HMDB0010325 HMDB View more database links Registry Numbers Types Sources 1247465 Reaxys Registry Number Reaxys 17685-04-0 CAS Registry Number ChemIDplus Citation Type Source 24023812 PubMed citation Europe PMC Last Modified 23 October 2015