EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:31775 - Liranaftate

ChEBI IDCHEBI:31775
ChEBI NameLiranaftate
Stars
Secondary ChEBI IDCHEBI:95257
Last Modified6 March 2017
DownloadsMolfile
FormulaC18H20N2O2S
Net Charge0
Average Mass328.437
Monoisotopic Mass328.12455
SMILESCOc1cccc(N(C)C(=S)Oc2ccc3c(c2)CCCC3)n1
InChIInChI=1S/C18H20N2O2S/c1-20(16-8-5-9-17(19-16)21-2)18(23)22-15-11-10-13-6-3-4-7-14(13)12-15/h5,8-12H,3-4,6-7H2,1-2H3
InChIKeyVPHPQNGOVQYUMG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Liranaftate (CHEBI:31775) is a tetralins (CHEBI:36786)
Synonyms  Source
LiranaftateKEGG COMPOUND
Zefnart (TN)KEGG COMPOUND
piritetrateDrugCentral
Manual XrefsDatabases
D01550KEGG DRUG
LSM-6583LINCS
1586DrugCentral
Registry NumbersSources
CAS:88678-31-3KEGG COMPOUND
CAS:88678-31-3DrugCentral