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CHEBI:175128 - O-Desmethylcarvedilol

ChEBI IDCHEBI:175128
ChEBI NameO-Desmethylcarvedilol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H24N2O4
Net Charge0
Average Mass392.455
Monoisotopic Mass392.17361
SMILESOc1ccccc1OCCNCC(O)COc1cccc2nc3ccccc3c12
InChIInChI=1S/C23H24N2O4/c26-16(14-24-12-13-28-21-10-4-3-9-20(21)27)15-29-22-11-5-8-19-23(22)17-6-1-2-7-18(17)25-19/h1-11,16,24-27H,12-15H2
InChIKeyXAUKPPPYYOKVQJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
O-Desmethylcarvedilol (CHEBI:175128) is a carbazoles (CHEBI:48513)
IUPAC Name 
2-[2-[[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]amino]ethoxy]phenol
Manual XrefsDatabases
137205ChemSpider
HMDB0013949HMDB
Registry NumbersSources
CAS:72956-44-6ChemIDplus