4-(dimethylamino)-N-[(2R,3R)-5-[(2S)-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:128843)

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CHEBI:128843 - 4-(dimethylamino)-N-[(2R,3R)-5-[(2S)-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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ChEBI ID	CHEBI:128843
ChEBI Name	4-(dimethylamino)-N-[(2R,3R)-5-[(2S)-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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Downloads	Molfile

Formula	C31H43F3N4O4
Net Charge	0
Average Mass	592.703
Monoisotopic Mass	592.32364
SMILES	C[C@@H]1CN([C@@H](C)CO)C(=O)Cc2cc(NC(=O)CCCN(C)C)ccc2O[C@H]1CN(C)Cc1ccc(C(F)(F)F)cc1
InChI	InChI=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+/m1/s1
InChIKey	BJJGXPXCVKSWPC-WENCSYSZSA-N

ChEBI Ontology

Outgoing Relation(s)
	4-(dimethylamino)-N-[(2R,3R)-5-[(2S)-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:128843) is a (trifluoromethyl)benzenes (CHEBI:83565)

Manual Xrefs	Databases
LSM-40395	LINCS