CHEBI:89556 - Vanilloylglycine

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name Vanilloylglycine ChEBI ID CHEBI:89556 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 C10H11NO5 Net Charge 0 Average Mass 225.198 Monoisotopic Mass 225.06372 InChI InChI=1S/C10H11NO5/c1-16-8-4-6(2-3-7(8)12)10(15)11-5-9(13)14/h2-4,12H,5H2,1H3,(H,11,15)(H,13,14) InChIKey LOODYTDRRBLQNH-UHFFFAOYSA-N SMILES COC1=C(C=CC(=C1)C(=O)NCC(=O)O)O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing Vanilloylglycine (CHEBI:89556) is a N-acylglycine (CHEBI:16180) Synonyms Sources 2-[(4-hydroxy-3-methoxybenzoyl)amino]acetic acid HMDB 2-[(4-hydroxy-3-methoxyphenyl)formamido]acetic acid HMDB 3-Methoxy-4-hydroxyhippuric acid HMDB Manual Xref Database HMDB0060026 HMDB View more database links Citation Type Source 22827565 PubMed citation Europe PMC