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CHEBI:32008 - Pipethanate hydrochloride

ChEBI IDCHEBI:32008
ChEBI NamePipethanate hydrochloride
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC21H25NO3.HCl
Net Charge0
Average Mass375.896
Monoisotopic Mass375.16012
SMILESCl.O=C(OCCN1CCCCC1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H25NO3.ClH/c23-20(25-17-16-22-14-8-3-9-15-22)21(24,18-10-4-1-5-11-18)19-12-6-2-7-13-19;/h1-2,4-7,10-13,24H,3,8-9,14-17H2;1H
InChIKeyZJVKLBBPLUXEAC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Pipethanate hydrochloride (CHEBI:32008) is a diarylmethane (CHEBI:51614)
Synonyms  Source
Pipethanate hydrochlorideKEGG COMPOUND
Piperilate hydrochlorideKEGG COMPOUND
Manual XrefsDatabases
D01521KEGG DRUG
Registry NumbersSources
CAS:4544-15-4KEGG COMPOUND