N-[(5S,6R,9R)-5-methoxy-8-[(3-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide (CHEBI:115406)

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CHEBI:115406 - N-[(5S,6R,9R)-5-methoxy-8-[(3-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide

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ChEBI ID	CHEBI:115406
ChEBI Name	N-[(5S,6R,9R)-5-methoxy-8-[(3-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
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Downloads	Molfile

Formula	C29H39N5O6S
Net Charge	0
Average Mass	585.727
Monoisotopic Mass	585.26210
SMILES	COc1cccc(CN2C[C@@H](C)[C@H](OC)CN(C)C(=O)c3ccc(NS(=O)(=O)c4cn(C)cn4)cc3OC[C@H]2C)c1
InChI	InChI=1S/C29H39N5O6S/c1-20-14-34(15-22-8-7-9-24(12-22)38-5)21(2)18-40-26-13-23(31-41(36,37)28-17-32(3)19-30-28)10-11-25(26)29(35)33(4)16-27(20)39-6/h7-13,17,19-21,27,31H,14-16,18H2,1-6H3/t20-,21-,27-/m1/s1
InChIKey	PBRMDHGSJWKIAR-LGVUCKNBSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(5S,6R,9R)-5-methoxy-8-[(3-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide (CHEBI:115406) is a azamacrocycle (CHEBI:52898)
	N-[(5S,6R,9R)-5-methoxy-8-[(3-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide (CHEBI:115406) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-26863	LINCS