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CHEBI:94729 - 5-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one

ChEBI IDCHEBI:94729
ChEBI Name5-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one
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DownloadsMolfile
FormulaC17H25NO3
Net Charge0
Average Mass291.391
Monoisotopic Mass291.18344
SMILESCC(C)(C)NC[C@@H](O)COc1cccc2c1CCCC2=O
InChIInChI=1S/C17H25NO3/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3/t12-/m1/s1
InChIKeyIXHBTMCLRNMKHZ-GFCCVEGCSA-N
ChEBI Ontology
Outgoing Relation(s)
5-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one (CHEBI:94729) is a tetralins (CHEBI:36786)
Manual XrefsDatabases
LSM-5810LINCS