EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:144166 - 4-O-methylolivetolcarboxylic acid

Default Structure
ChEBI IDCHEBI:144166
ChEBI Name4-O-methylolivetolcarboxylic acid
Stars
Submittermwilliams
DownloadsMolfile
FormulaC13H18O4
Net Charge0
Average Mass238.283
Monoisotopic Mass238.12051
SMILESCCCCCc1cc(OC)cc(O)c1C(=O)O
InChIInChI=1S/C13H18O4/c1-3-4-5-6-9-7-10(17-2)8-11(14)12(9)13(15)16/h7-8,14H,3-6H2,1-2H3,(H,15,16)
InChIKeyJWSADSZPLGCVPA-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-O-methylolivetolcarboxylic acid (CHEBI:144166) is a methoxybenzoic acid (CHEBI:25238)