N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methoxybenzenesulfonamide (CHEBI:94946)

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CHEBI:94946 - N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methoxybenzenesulfonamide

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ChEBI ID	CHEBI:94946
ChEBI Name	N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methoxybenzenesulfonamide
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Downloads	Molfile

Formula	C32H49N3O7S
Net Charge	0
Average Mass	619.825
Monoisotopic Mass	619.32912
SMILES	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N([C@@H](C)CO)C[C@H]1C
InChI	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25-,31-/m1/s1
InChIKey	ZZWVGKUDLRNMBI-XDAUYTPDSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methoxybenzenesulfonamide (CHEBI:94946) is a azamacrocycle (CHEBI:52898)
	N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methoxybenzenesulfonamide (CHEBI:94946) is a lactam (CHEBI:24995)

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LSM-6165	LINCS