EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:107186 - 4-[(1-naphthalenylamino)-oxomethyl]benzene-1,3-dicarboxylic acid

ChEBI IDCHEBI:107186
ChEBI Name4-[(1-naphthalenylamino)-oxomethyl]benzene-1,3-dicarboxylic acid
Stars
DownloadsMolfile
FormulaC19H13NO5
Net Charge0
Average Mass335.315
Monoisotopic Mass335.07937
SMILESO=C(O)c1ccc(C(=O)Nc2cccc3ccccc23)c(C(=O)O)c1
InChIInChI=1S/C19H13NO5/c21-17(14-9-8-12(18(22)23)10-15(14)19(24)25)20-16-7-3-5-11-4-1-2-6-13(11)16/h1-10H,(H,20,21)(H,22,23)(H,24,25)
InChIKeyMXKJSOMQCBHQQL-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-[(1-naphthalenylamino)-oxomethyl]benzene-1,3-dicarboxylic acid (CHEBI:107186) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Manual XrefsDatabases
LSM-18540LINCS