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CHEBI:6752 - Mepenzolate

ChEBI IDCHEBI:6752
ChEBI NameMepenzolate
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H25NO3
Net Charge0
Average Mass339.435
Monoisotopic Mass339.18344
SMILESC[N+]1(C)CCCC(OC(=O)C([O-])(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C21H25NO3/c1-22(2)15-9-14-19(16-22)25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19H,9,14-16H2,1-2H3
InChIKeyQVXXCOQHOPMUHU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Mepenzolate (CHEBI:6752) is a diarylmethane (CHEBI:51614)
Synonym  Source
MepenzolateKEGG COMPOUND
Manual XrefsDatabases
C07818KEGG COMPOUND
Registry NumbersSources
CAS:25990-43-6KEGG COMPOUND