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CHEBI:82641 - gepinacin

ChEBI IDCHEBI:82641
ChEBI Namegepinacin
Stars
DefinitionA monocarboxylic acid amide obtained by formal condensation of the carboxy group of 3-isobutoxyphenoxyacetic acid with the amino group of 4-methoxyaniline.
Last Modified6 August 2014
SubmitterSteve
DownloadsMolfile
FormulaC19H23NO4
Net Charge0
Average Mass329.396
Monoisotopic Mass329.16271
SMILESCOc1ccc(NC(=O)COc2cccc(OCC(C)C)c2)cc1
InChIInChI=1S/C19H23NO4/c1-14(2)12-23-17-5-4-6-18(11-17)24-13-19(21)20-15-7-9-16(22-3)10-8-15/h4-11,14H,12-13H2,1-3H3,(H,20,21)
InChIKeyJNQHDEHVHXLCAL-UHFFFAOYSA-N
Roles Classification
Biological Roles:
glycerophosphoinositol synthesis inhibitor  A pathway inhibitor that disrupts the synthesis of glycerophosphoinositol
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
ChEBI Ontology
Outgoing Relation(s)
gepinacin (CHEBI:82641) has functional parent phenylacetic acid (CHEBI:30745)
gepinacin (CHEBI:82641) has role antifungal agent (CHEBI:35718)
gepinacin (CHEBI:82641) has role glycerophosphoinositol synthesis inhibitor (CHEBI:79386)
gepinacin (CHEBI:82641) is a aromatic amide (CHEBI:62733)
gepinacin (CHEBI:82641) is a aromatic ether (CHEBI:35618)
gepinacin (CHEBI:82641) is a monocarboxylic acid amide (CHEBI:29347)
IUPAC Name 
2-(3-isobutoxyphenoxy)-N-(4-methoxyphenyl)acetamide
Manual XrefsDatabases
WO2013192517Patent
Citations