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CHEBI:95547 - N-[[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide

ChEBI IDCHEBI:95547
ChEBI NameN-[[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide
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FormulaC29H39N3O5
Net Charge0
Average Mass509.647
Monoisotopic Mass509.28897
SMILESCOc1ccc(-c2cnc3c(c2)C(=O)N([C@@H](C)CO)C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)O3)cc1
InChIInChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26-/m1/s1
InChIKeyBHKYXVBLKIOFCQ-BVFVYWQFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide (CHEBI:95547) is a phenylpyridine (CHEBI:38193)
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