EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:172338 - N-Desmethyltramadol

ChEBI IDCHEBI:172338
ChEBI NameN-Desmethyltramadol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H23NO2
Net Charge0
Average Mass249.354
Monoisotopic Mass249.17288
SMILESCNCC1CCCCC1(O)c1cccc(OC)c1
InChIInChI=1S/C15H23NO2/c1-16-11-13-6-3-4-9-15(13,17)12-7-5-8-14(10-12)18-2/h5,7-8,10,13,16-17H,3-4,6,9,11H2,1-2H3
InChIKeyVUMQHLSPUAFKKK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-Desmethyltramadol (CHEBI:172338) is a methoxybenzenes (CHEBI:51683)
IUPAC Name 
1-(3-methoxyphenyl)-2-(methylaminomethyl)cyclohexan-1-ol
Manual XrefsDatabases
171856ChemSpider
HMDB0061007HMDB
Registry NumbersSources
CAS:73806-55-0ChemIDplus