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CHEBI:129037 - (2R,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-8-[2-(4-methoxyphenyl)ethynyl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

ChEBI IDCHEBI:129037
ChEBI Name(2R,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-8-[2-(4-methoxyphenyl)ethynyl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
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DownloadsMolfile
FormulaC28H35N3O4
Net Charge0
Average Mass477.605
Monoisotopic Mass477.26276
SMILESCOc1ccc(C#Cc2cnc3c(c2)C(=O)N([C@@H](C)CO)C[C@H](C)[C@H](CN(C)CC2CC2)O3)cc1
InChIInChI=1S/C28H35N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(8-5-21-9-11-24(34-4)12-10-21)14-29-27(25)35-26(19)17-30(3)16-22-6-7-22/h9-14,19-20,22,26,32H,6-7,15-18H2,1-4H3/t19-,20-,26-/m0/s1
InChIKeyRQFWBZRQAPJIEY-DYLHXGEVSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-8-[2-(4-methoxyphenyl)ethynyl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:129037) is a methoxybenzenes (CHEBI:51683)
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