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CHEBI:192203 - Didesmethyl doxepin

ChEBI IDCHEBI:192203
ChEBI NameDidesmethyl doxepin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H17NO
Net Charge0
Average Mass251.329
Monoisotopic Mass251.13101
SMILESNCC/C=C1\c2ccccc2COc2ccccc21
InChIInChI=1S/C17H17NO/c18-11-5-9-15-14-7-2-1-6-13(14)12-19-17-10-4-3-8-16(15)17/h1-4,6-10H,5,11-12,18H2/b15-9+
InChIKeyHLUSHBJOSPBFOC-OQLLNIDSSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
ChEBI Ontology
Outgoing Relation(s)
Didesmethyl doxepin (CHEBI:192203) is a dibenzooxazepine (CHEBI:53802)
IUPAC Name 
(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propan-1-amine
Manual XrefsDatabases
4939599ChemSpider
HMDB0060816HMDB