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CHEBI:96106 - 1-[[(2R,3S)-8-(3-fluorophenyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea

Default Structure
ChEBI IDCHEBI:96106
ChEBI Name1-[[(2R,3S)-8-(3-fluorophenyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea
Stars
DownloadsMolfile
FormulaC32H33FN4O4
Net Charge0
Average Mass556.638
Monoisotopic Mass556.24858
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ncc(-c3cccc(F)c3)cc2C1=O
InChIInChI=1S/C32H33FN4O4/c1-20-17-37(21(2)19-38)31(39)27-15-24(23-10-6-11-25(33)14-23)16-34-30(27)41-29(20)18-36(3)32(40)35-28-13-7-9-22-8-4-5-12-26(22)28/h4-16,20-21,29,38H,17-19H2,1-3H3,(H,35,40)/t20-,21+,29-/m0/s1
InChIKeyLFKRZQVCQDAKMN-FONBTEPMSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(2R,3S)-8-(3-fluorophenyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea (CHEBI:96106) is a phenylpyridine (CHEBI:38193)
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