N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-methoxybenzenesulfonamide (CHEBI:128419)

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CHEBI:128419 - N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-methoxybenzenesulfonamide

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ChEBI ID	CHEBI:128419
ChEBI Name	N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-methoxybenzenesulfonamide
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Downloads	Molfile

Formula	C31H36F3N3O6S
Net Charge	0
Average Mass	635.705
Monoisotopic Mass	635.22769
SMILES	COc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)N([C@@H](C)CO)C[C@@H](C)[C@H](CN(C)Cc2ccc(C(F)(F)F)cc2)O3)cc1
InChI	InChI=1S/C31H36F3N3O6S/c1-20-16-37(21(2)19-38)30(39)27-15-24(35-44(40,41)26-12-10-25(42-4)11-13-26)9-14-28(27)43-29(20)18-36(3)17-22-5-7-23(8-6-22)31(32,33)34/h5-15,20-21,29,35,38H,16-19H2,1-4H3/t20-,21+,29+/m1/s1
InChIKey	IIKKFGUOBGVCMI-CGQTXMLISA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-methoxybenzenesulfonamide (CHEBI:128419) is a sulfonamide (CHEBI:35358)

Manual Xrefs	Databases
LSM-39974	LINCS