CHEBI:112919 - 2-(3-bicyclo[2.2.1]heptanyl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-(3-bicyclo[2.2.1]heptanyl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
ChEBI ID CHEBI:112919
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H27NO3
Net Charge 0
Average Mass 329.434
Monoisotopic Mass 329.19909
InChI InChI=1S/C20H27NO3/c1-23-18-9-15-5-6-21(12-17(15)10-19(18)24-2)20(22)11-16-8-13-3-4-14(16)7-13/h9-10,13-14,16H,3-8,11-12H2,1-2H3
InChIKey MESVHWNKLKGEMS-UHFFFAOYSA-N
SMILES COC1=C(C=C2CN(CCC2=C1)C(=O)CC3CC4CCC3C4)OC
ChEBI Ontology
Outgoing 2-(3-bicyclo[2.2.1]heptanyl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone (CHEBI:112919) is a isoquinolines (CHEBI:24922)
Manual Xref Database
LSM-24329 LINCS
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