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CHEBI:230174 - (1R,9R,13R)-1,13-Dimethyl-10-[[(2R)-oxolan-2-yl]methyl]-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol

ChEBI IDCHEBI:230174
ChEBI Name(1R,9R,13R)-1,13-Dimethyl-10-[[(2R)-oxolan-2-yl]methyl]-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H27NO2
Net Charge0
Average Mass301.430
Monoisotopic Mass301.20418
SMILESCC1C2Cc3ccc(O)cc3C1(C)CCN2CC1CCCO1
InChIInChI=1S/C19H27NO2/c1-13-18-10-14-5-6-15(21)11-17(14)19(13,2)7-8-20(18)12-16-4-3-9-22-16/h5-6,11,13,16,18,21H,3-4,7-10,12H2,1-2H3
InChIKeyNLKLXMMOJZHSCB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
(1R,9R,13R)-1,13-Dimethyl-10-[[(2R)-oxolan-2-yl]methyl]-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol (CHEBI:230174) is a benzazocine (CHEBI:39307)
IUPAC Name 
1,13-dimethyl-10-(oxolan-2-ylmethyl)-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
Manual XrefsDatabases
HMDB0242342HMDB
4422751ChemSpider