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CHEBI:165221 - O-Desmethyltramadol

ChEBI IDCHEBI:165221
ChEBI NameO-Desmethyltramadol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H23NO2
Net Charge0
Average Mass249.354
Monoisotopic Mass249.17288
SMILESCN(C)C[C@H]1CCCC[C@]1(O)c1cccc(O)c1
InChIInChI=1S/C15H23NO2/c1-16(2)11-13-6-3-4-9-15(13,18)12-7-5-8-14(17)10-12/h5,7-8,10,13,17-18H,3-4,6,9,11H2,1-2H3/t13-,15+/m1/s1
InChIKeyUWJUQVWARXYRCG-HIFRSBDPSA-N
ChEBI Ontology
Outgoing Relation(s)
O-Desmethyltramadol (CHEBI:165221) is a alkylbenzene (CHEBI:38976)
O-Desmethyltramadol (CHEBI:165221) is a ring assembly (CHEBI:36820)
IUPAC Name 
3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenol
Manual XrefsDatabases
HMDB0060997HMDB
8014523ChemSpider
Registry NumbersSources
CAS:80456-81-1ChemIDplus