EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:135807 - tropesin

ChEBI IDCHEBI:135807
ChEBI Nametropesin
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC28H24ClNO6
Net Charge0
Average Mass505.954
Monoisotopic Mass505.12922
SMILESCOc1ccc2c(c1)c(CC(=O)OCC(C(=O)O)c1ccccc1)c(C)n2C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C28H24ClNO6/c1-17-22(15-26(31)36-16-24(28(33)34)18-6-4-3-5-7-18)23-14-21(35-2)12-13-25(23)30(17)27(32)19-8-10-20(29)11-9-19/h3-14,24H,15-16H2,1-2H3,(H,33,34)
InChIKeyUCCJWNPWWPJKGL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
tropesin (CHEBI:135807) is a N-acylindole (CHEBI:75884)
Synonym  Source
repanidalDrugCentral
Manual XrefsDatabases
2773DrugCentral
Registry NumbersSources
CAS:65189-78-8DrugCentral