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CHEBI:127939 - 4-(dimethylamino)-N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]butanamide

ChEBI IDCHEBI:127939
ChEBI Name4-(dimethylamino)-N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]butanamide
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DownloadsMolfile
FormulaC31H43F3N4O4
Net Charge0
Average Mass592.703
Monoisotopic Mass592.32364
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C(F)(F)F)cc2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O
InChIInChI=1S/C31H43F3N4O4/c1-21-17-38(22(2)20-39)30(41)16-24-15-26(35-29(40)7-6-14-36(3)4)12-13-27(24)42-28(21)19-37(5)18-23-8-10-25(11-9-23)31(32,33)34/h8-13,15,21-22,28,39H,6-7,14,16-20H2,1-5H3,(H,35,40)/t21-,22+,28+/m0/s1
InChIKeyBJJGXPXCVKSWPC-PFPZSTESSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(dimethylamino)-N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]butanamide (CHEBI:127939) is a (trifluoromethyl)benzenes (CHEBI:83565)
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