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CHEBI:31759 - Lafutidine

Default Structure
ChEBI IDCHEBI:31759
ChEBI NameLafutidine
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC22H29N3O4S
Net Charge0
Average Mass431.558
Monoisotopic Mass431.18788
SMILESO=C(CS(=O)Cc1ccco1)NC/C=C\COc1cc(CN2CCCCC2)ccn1
InChIInChI=1S/C22H29N3O4S/c26-21(18-30(27)17-20-7-6-14-28-20)23-9-2-5-13-29-22-15-19(8-10-24-22)16-25-11-3-1-4-12-25/h2,5-8,10,14-15H,1,3-4,9,11-13,16-18H2,(H,23,26)/b5-2-
InChIKeyKMZQAVXSMUKBPD-DJWKRKHSSA-N
ChEBI Ontology
Outgoing Relation(s)
Lafutidine (CHEBI:31759) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
FRG 8813DrugCentral
FRG-8813DrugCentral
laflutidineDrugCentral
LafutidineKEGG COMPOUND
protecadinDrugCentral
Manual XrefsDatabases
1537DrugCentral
D01131KEGG DRUG
HMDB0240216HMDB
Registry NumbersSources
CAS:118288-08-7KEGG COMPOUND
CAS:206449-93-6DrugCentral