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CHEBI:128587 - 1-cyclohexyl-3-[(2R,3R)-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 IDCHEBI:128587
ChEBI Name1-cyclohexyl-3-[(2R,3R)-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
Stars
DownloadsMolfile
FormulaC31H41F3N4O4
Net Charge0
Average Mass590.687
Monoisotopic Mass590.30799
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cccc(NC(=O)NC3CCCCC3)c2O[C@H]1CN(C)Cc1ccc(C(F)(F)F)cc1
InChIInChI=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+/m1/s1
InChIKeyNHGHJDDGJPIKGB-GNMOFYLKSA-N
ChEBI Ontology
Outgoing Relation(s)
1-cyclohexyl-3-[(2R,3R)-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:128587) is a (trifluoromethyl)benzenes (CHEBI:83565)
Manual XrefsDatabases
LSM-40141LINCS