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CHEBI:106155 - (2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-8-(2-methylphenyl)-2-[[methyl(5-pyrimidinylmethyl)amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

ChEBI IDCHEBI:106155
ChEBI Name(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-8-(2-methylphenyl)-2-[[methyl(5-pyrimidinylmethyl)amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
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DownloadsMolfile
FormulaC27H33N5O3
Net Charge0
Average Mass475.593
Monoisotopic Mass475.25834
SMILESCc1ccccc1-c1cnc2c(c1)C(=O)N([C@@H](C)CO)C[C@H](C)[C@@H](CN(C)Cc1cncnc1)O2
InChIInChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25+/m0/s1
InChIKeyXPLVEXAVWRQRFN-ZYLNGJIFSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-8-(2-methylphenyl)-2-[[methyl(5-pyrimidinylmethyl)amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:106155) is a phenylpyridine (CHEBI:38193)
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