EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:34713 - dimepiperate

Default Structure
ChEBI IDCHEBI:34713
ChEBI Namedimepiperate
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H21NOS
Net Charge0
Average Mass263.406
Monoisotopic Mass263.13439
SMILESCC(C)(SC(=O)N1CCCCC1)c1ccccc1
InChIInChI=1S/C15H21NOS/c1-15(2,13-9-5-3-6-10-13)18-14(17)16-11-7-4-8-12-16/h3,5-6,9-10H,4,7-8,11-12H2,1-2H3
InChIKeyBWUPSGJXXPATLU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
dimepiperate (CHEBI:34713) is a monothiocarbamic ester (CHEBI:38128)
dimepiperate (CHEBI:34713) is a piperidinecarboxylate ester (CHEBI:48630)
Synonyms  Source
DimepiperateKEGG COMPOUND
S-1-Methyl-1-phenylethyl piperidine 1-carbothioateKEGG COMPOUND
Manual XrefsDatabases
238PPDB
C14571KEGG COMPOUND
Registry NumbersSources
CAS:61432-55-1KEGG COMPOUND