Preferred Name |
ibutilide |
|
Synonyms |
ibutilide fumarate U 82209E U-82209E U82209E Ibutilide |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_5856 |
|
alternative term |
ibutilide fumarate U 82209E U-82209E U82209E Ibutilide |
|
charge |
0 |
|
database_cross_reference |
HMDB:HMDB0014453 Drug_Central:1412 KEGG:C07753 KEGG:D08060 CAS:122647-31-8 |
|
formula |
C20H36N2O3S |
|
has_exact_synonym |
Ibutilide |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
ibutilide fumarate U 82209E U-82209E U82209E |
|
has_RxCUI |
41289 |
|
id |
CHEBI:5856 |
|
in_subset | ||
inchi |
InChI=1S/C20H36N2O3S/c1-4-6-7-8-9-16-22(5-2)17-10-11-20(23)18-12-14-19(15-13-18)21-26(3,24)25/h12-15,20-21,23H,4-11,16-17H2,1-3H3 |
|
inchikey |
ALOBUEHUHMBRLE-UHFFFAOYSA-N |
|
label |
Ibutilide ibutilide |
|
mass |
384.578 |
|
monoisotopicmass |
384.24466 |
|
notation |
CHEBI:5856 |
|
prefixIRI |
CHEBI:5856 |
|
prefLabel |
ibutilide |
|
smiles |
CCCCCCCN(CC)CCCC(O)c1ccc(NS(C)(=O)=O)cc1 |
|
subClassOf |
Create mapping