N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[3-(trifluoromethyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methylimidazole-4-sulfonamide (CHEBI:98071)

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CHEBI:98071 - N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[3-(trifluoromethyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methylimidazole-4-sulfonamide

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ChEBI ID	CHEBI:98071
ChEBI Name	N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[3-(trifluoromethyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methylimidazole-4-sulfonamide
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Downloads	Molfile

Formula	C29H36F3N5O5S
Net Charge	0
Average Mass	623.698
Monoisotopic Mass	623.23892
SMILES	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc2cccc(C(F)(F)F)c2)C[C@H]1C
InChI	InChI=1S/C29H36F3N5O5S/c1-19-13-37(14-21-7-6-8-22(11-21)29(30,31)32)20(2)17-42-25-12-23(34-43(39,40)27-16-35(3)18-33-27)9-10-24(25)28(38)36(4)15-26(19)41-5/h6-12,16,18-20,26,34H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1
InChIKey	KOOKBFWCLZTKPR-XMERXJNXSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[3-(trifluoromethyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methylimidazole-4-sulfonamide (CHEBI:98071) is a azamacrocycle (CHEBI:52898)
	N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[3-(trifluoromethyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methylimidazole-4-sulfonamide (CHEBI:98071) is a lactam (CHEBI:24995)

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