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CHEBI:96533 - (2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

ChEBI IDCHEBI:96533
ChEBI Name(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
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FormulaC30H37N3O4
Net Charge0
Average Mass503.643
Monoisotopic Mass503.27841
SMILESCOc1ccc(-c2cnc3c(c2)C(=O)N([C@H](C)CO)C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)O3)cc1
InChIInChI=1S/C30H37N3O4/c1-20-7-6-8-23(13-20)17-32(4)18-28-21(2)16-33(22(3)19-34)30(35)27-14-25(15-31-29(27)37-28)24-9-11-26(36-5)12-10-24/h6-15,21-22,28,34H,16-19H2,1-5H3/t21-,22+,28-/m0/s1
InChIKeyWIXJEAGMVWOKSS-TYPXCFOJSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-2-[[methyl-[(3-methylphenyl)methyl]amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:96533) is a phenylpyridine (CHEBI:38193)
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