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CHEBI:123680 - N-[(2S,3R)-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]-2-(1-tetrazolyl)acetamide

ChEBI IDCHEBI:123680
ChEBI NameN-[(2S,3R)-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]-2-(1-tetrazolyl)acetamide
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DownloadsMolfile
FormulaC28H34F3N7O4
Net Charge0
Average Mass589.619
Monoisotopic Mass589.26244
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)Cc2cc(NC(=O)Cn3cnnn3)ccc2O[C@@H]1CN(C)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C28H34F3N7O4/c1-18-12-38(19(2)16-39)27(41)11-21-10-23(33-26(40)15-37-17-32-34-35-37)8-9-24(21)42-25(18)14-36(3)13-20-4-6-22(7-5-20)28(29,30)31/h4-10,17-19,25,39H,11-16H2,1-3H3,(H,33,40)/t18-,19-,25-/m1/s1
InChIKeyRGXHKJAVIOAWHC-MPCDZSKCSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-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]-2-(1-tetrazolyl)acetamide (CHEBI:123680) is a (trifluoromethyl)benzenes (CHEBI:83565)
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