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CHEBI:124432 - N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide

ChEBI IDCHEBI:124432
ChEBI NameN-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
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DownloadsMolfile
FormulaC30H32F3N5O5
Net Charge0
Average Mass599.610
Monoisotopic Mass599.23555
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(C(F)(F)F)cc2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O
InChIInChI=1S/C30H32F3N5O5/c1-18-15-38(19(2)17-39)28(41)24-14-23(35-27(40)20-10-12-34-13-11-20)8-9-25(24)43-26(18)16-37(3)29(42)36-22-6-4-21(5-7-22)30(31,32)33/h4-14,18-19,26,39H,15-17H2,1-3H3,(H,35,40)(H,36,42)/t18-,19+,26-/m0/s1
InChIKeyCEYHIDAYCYBVJJ-ANSQWYIGSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide (CHEBI:124432) is a ureas (CHEBI:47857)
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