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CHEBI:127719 - (2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-8-(4-methylphenyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

ChEBI IDCHEBI:127719
ChEBI Name(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-8-(4-methylphenyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
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DownloadsMolfile
FormulaC22H29N3O3
Net Charge0
Average Mass383.492
Monoisotopic Mass383.22089
SMILESCNC[C@H]1Oc2ncc(-c3ccc(C)cc3)cc2C(=O)N([C@H](C)CO)C[C@H]1C
InChIInChI=1S/C22H29N3O3/c1-14-5-7-17(8-6-14)18-9-19-21(24-10-18)28-20(11-23-4)15(2)12-25(22(19)27)16(3)13-26/h5-10,15-16,20,23,26H,11-13H2,1-4H3/t15-,16-,20-/m1/s1
InChIKeyJKHLNYMUPUVSIB-JXXFODFXSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-8-(4-methylphenyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:127719) is a phenylpyridine (CHEBI:38193)
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LSM-39276LINCS