CHEBI:34736 - Emopamil

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ChEBI Name Emopamil
ChEBI ID CHEBI:34736
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C23H30N2
Net Charge 0
Average Mass 334.499
Monoisotopic Mass 334.24090
InChI InChI=1S/C23H30N2/c1-20(2)23(19-24,22-13-8-5-9-14-22)16-10-17-25(3)18-15-21-11-6-4-7-12-21/h4-9,11-14,20H,10,15-18H2,1-3H3
InChIKey DWAWDSVKAUWFHC-UHFFFAOYSA-N
SMILES CC(C)C(CCCN(C)CCc1ccccc1)(C#N)c1ccccc1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Emopamil (CHEBI:34736) is a benzenes (CHEBI:22712)
Emopamil (CHEBI:34736) is a organic amino compound (CHEBI:50047)
Synonym Source
Emopamil KEGG COMPOUND
Manual Xrefs Databases
C13766 KEGG COMPOUND
HMDB0012224 HMDB
View more database links
Registry Number Type Source
78370-13-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014