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CHEBI:175368 - 4'-Hydroxyphenyl Carvedilol

ChEBI IDCHEBI:175368
ChEBI Name4'-Hydroxyphenyl Carvedilol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26N2O5
Net Charge0
Average Mass422.481
Monoisotopic Mass422.18417
SMILESCOc1cc(O)ccc1OCCNCC(O)COc1cccc2nc3ccccc3c12
InChIInChI=1S/C24H26N2O5/c1-29-23-13-16(27)9-10-21(23)30-12-11-25-14-17(28)15-31-22-8-4-7-20-24(22)18-5-2-3-6-19(18)26-20/h2-10,13,17,25-28H,11-12,14-15H2,1H3
InChIKeyZCJHEORDHXCJNB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4'-Hydroxyphenyl Carvedilol (CHEBI:175368) is a carbazoles (CHEBI:48513)
IUPAC Name 
4-[2-[[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]amino]ethoxy]-3-methoxyphenol
Manual XrefsDatabases
3765669ChemSpider
HMDB0060773HMDB
Registry NumbersSources
CAS:142227-49-4ChemIDplus