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CHEBI:190355 - 3-(2,4-dihydroxy-5-methoxyphenyl)propanoic acid

ChEBI IDCHEBI:190355
ChEBI Name3-(2,4-dihydroxy-5-methoxyphenyl)propanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H12O5
Net Charge0
Average Mass212.201
Monoisotopic Mass212.06847
SMILESCOc1cc(CCC(=O)O)c(O)cc1O
InChIInChI=1S/C10H12O5/c1-15-9-4-6(2-3-10(13)14)7(11)5-8(9)12/h4-5,11-12H,2-3H2,1H3,(H,13,14)
InChIKeyPLLIJHAKLDZNQC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) intestinal content (NCIT:C189653) MetaboLights (MTBLS4101) Strain: C57BL/6J  [EFO:0000606]
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-(2,4-dihydroxy-5-methoxyphenyl)propanoic acid (CHEBI:190355) is a benzenes (CHEBI:22712)
3-(2,4-dihydroxy-5-methoxyphenyl)propanoic acid (CHEBI:190355) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name 
3-(2,4-dihydroxy-5-methoxyphenyl)propanoic acid
Manual XrefsDatabases
62818848ChemSpider
HMDB0125520HMDB