EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:2664 - Amiodarone hydrochloride

ChEBI IDCHEBI:2664
ChEBI NameAmiodarone hydrochloride
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC25H29I2NO3.HCl
Net Charge0
Average Mass681.780
Monoisotopic Mass681.00037
SMILESCCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN(CC)CC)c(I)c1.Cl
InChIInChI=1S/C25H29I2NO3.ClH/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3;/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3;1H
InChIKeyITPDYQOUSLNIHG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Amiodarone hydrochloride (CHEBI:2664) is a aromatic ketone (CHEBI:76224)
Synonyms  Source
Amiodarone hydrochlorideKEGG COMPOUND
Cordarone (TN)KEGG COMPOUND
Manual XrefsDatabases
D00636KEGG DRUG
Registry NumbersSources
CAS:19774-82-4KEGG COMPOUND