N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-fluorobenzenesulfonamide (CHEBI:128181)

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CHEBI:128181 - N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-fluorobenzenesulfonamide

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ChEBI ID	CHEBI:128181
ChEBI Name	N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-fluorobenzenesulfonamide
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Last Modified	3 March 2016
Downloads	Molfile

Formula	C32H46FN3O6S
Net Charge	0
Average Mass	619.800
Monoisotopic Mass	619.30914
SMILES	C[C@@H]1CCCCO[C@H](CN(C)CC2CC2)[C@H](C)CN([C@@H](C)CO)C(=O)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2O1
InChI	InChI=1S/C32H46FN3O6S/c1-22-18-36(23(2)21-37)32(38)29-17-27(34-43(39,40)28-13-10-26(33)11-14-28)12-15-30(29)42-24(3)7-5-6-16-41-31(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,31,34,37H,5-9,16,18-21H2,1-4H3/t22-,23+,24-,31-/m1/s1
InChIKey	RTHCXGNRZPZERE-UMLQYNHOSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-fluorobenzenesulfonamide (CHEBI:128181) is a azamacrocycle (CHEBI:52898)
	N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-fluorobenzenesulfonamide (CHEBI:128181) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-39736	LINCS