1-cyclohexyl-3-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea (CHEBI:125938)

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CHEBI:125938 - 1-cyclohexyl-3-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea

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ChEBI ID	CHEBI:125938
ChEBI Name	1-cyclohexyl-3-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
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Formula	C31H41F3N4O4
Net Charge	0
Average Mass	590.687
Monoisotopic Mass	590.30799
SMILES	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C(F)(F)F)cc2)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O
InChI	InChI=1S/C31H41F3N4O4/c1-20-16-38(21(2)19-39)29(40)25-10-7-11-26(36-30(41)35-24-8-5-4-6-9-24)28(25)42-27(20)18-37(3)17-22-12-14-23(15-13-22)31(32,33)34/h7,10-15,20-21,24,27,39H,4-6,8-9,16-19H2,1-3H3,(H2,35,36,41)/t20-,21+,27-/m0/s1
InChIKey	NHGHJDDGJPIKGB-ISCCLHIJSA-N

ChEBI Ontology

Outgoing Relation(s)
	1-cyclohexyl-3-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea (CHEBI:125938) is a (trifluoromethyl)benzenes (CHEBI:83565)

Manual Xrefs	Databases
LSM-37505	LINCS