CHEBI:80622 - Albendazole-beta-hydroxysulphone

ChEBI IDCHEBI:80622
ChEBI NameAlbendazole-beta-hydroxysulphone
Stars
DownloadsMolfile
FormulaC12H15N3O5S
Net Charge0
Average Mass313.335
Monoisotopic Mass313.07324
SMILESCOC(=O)Nc1nc2ccc(S(=O)(=O)CC(C)O)cc2n1
InChIInChI=1S/C12H15N3O5S/c1-7(16)6-21(18,19)8-3-4-9-10(5-8)14-11(13-9)15-12(17)20-2/h3-5,7,16H,6H2,1-2H3,(H2,13,14,15,17)
InChIKeyHXRHOFREEVMBGY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Albendazole-beta-hydroxysulphone (CHEBI:80622) is a organic sulfide (CHEBI:16385)
Manual XrefsDatabases
C16628KEGG COMPOUND
Registry NumbersSources
CAS:80983-30-8KEGG COMPOUND