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CHEBI:88526 - Vanillactic acid

ChEBI IDCHEBI:88526
ChEBI NameVanillactic acid
Stars
DownloadsMolfile
FormulaC10H12O5
Net Charge0
Average Mass212.201
Monoisotopic Mass212.06847
SMILESCOc1cc(CC(O)C(=O)O)ccc1O
InChIInChI=1S/C10H12O5/c1-15-9-5-6(2-3-7(9)11)4-8(12)10(13)14/h2-3,5,8,11-12H,4H2,1H3,(H,13,14)
InChIKeySVYIZYRTOYHQRE-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (24023812)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Vanillactic acid (CHEBI:88526) has functional parent pyruvic acid (CHEBI:32816)
Vanillactic acid (CHEBI:88526) is a 2-oxo monocarboxylic acid (CHEBI:35910)
Synonyms  Source
3-(4-Hydroxy-3-methoxyphenyl)-Lactic acidHMDB
beta-(4-Hydroxy-3-methoxyphenyl)lactic acidHMDB
3-(4-Hydroxy-3-methoxyphenyl)lactateHMDB
VanillactateHMDB
3-(3-Methoxy-4-hydroxyphenyl)lactateHMDB
3-(4-Hydroxy-3-methoxyphenyl)-LactateHMDB
Manual XrefsDatabases
HMDB0000913HMDB
VLAWikipedia
Registry NumbersSources
CAS:2475-56-1KEGG COMPOUND
Citations