CHEBI:6753 - Mepenzolate bromide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Mepenzolate bromide
ChEBI ID CHEBI:6753
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C21H26BrNO3
C21H26NO3.Br
Net Charge 0
Average Mass 420.340
Monoisotopic Mass 419.10961
InChI InChI=1S/C21H26NO3.BrH/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;/h3-8,10-13,19,24H,9,14-16H2,1-2H3;1H/q+1;/p-1
InChIKey JRRNZNSGDSFFIR-UHFFFAOYSA-M
SMILES [Br-].C1CC(OC(C(C=2C=CC=CC2)(C3=CC=CC=C3)O)=O)C[N+](C1)(C)C
ChEBI Ontology
Outgoing Mepenzolate bromide (CHEBI:6753) is a diarylmethane (CHEBI:51614)
Synonyms Sources
Cantil (TN) KEGG COMPOUND
Mepenzolate bromide KEGG COMPOUND
Manual Xref Database
D00720 KEGG DRUG
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Registry Number Type Source
76-90-4 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017