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CHEBI:8769 - rabeprazole sodium

ChEBI IDCHEBI:8769
ChEBI Namerabeprazole sodium
Stars
Last Modified2 May 2008
DownloadsMolfile
FormulaC18H20N3O3S.Na
Net Charge0
Average Mass381.433
Monoisotopic Mass381.11231
SMILESCOCCCOc1ccnc(CS(=O)c2nc3ccccc3[n-]2)c1C.[Na+]
InChIInChI=1S/C18H20N3O3S.Na/c1-13-16(19-9-8-17(13)24-11-5-10-23-2)12-25(22)18-20-14-6-3-4-7-15(14)21-18;/h3-4,6-9H,5,10-12H2,1-2H3;/q-1;+1
InChIKeyKRCQSTCYZUOBHN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
rabeprazole sodium (CHEBI:8769) has part rabeprazole(1−) (CHEBI:49199)
rabeprazole sodium (CHEBI:8769) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
sodium 2-({[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methyl}sulfinyl)benzimidazol-1-ide
Synonyms  Source
Rabeprazole sodiumKEGG COMPOUND
Sodium rabeprazoleKEGG DRUG
AciphexKEGG DRUG
Brand Names  Source
ParietDrugBank
AcipHexDrugBank
Manual XrefsDatabases
C07865KEGG COMPOUND
D00724KEGG DRUG
Registry NumbersSources
Beilstein:7561607Beilstein
CAS:117976-90-6KEGG COMPOUND
CAS:117976-90-6ChemIDplus