N-[(5S,6R,9S)-5-methoxy-8-[(4-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide (CHEBI:111845)

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CHEBI:111845 - N-[(5S,6R,9S)-5-methoxy-8-[(4-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide

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ChEBI ID	CHEBI:111845
ChEBI Name	N-[(5S,6R,9S)-5-methoxy-8-[(4-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
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Downloads	Molfile

Formula	C33H38N4O5S
Net Charge	0
Average Mass	602.757
Monoisotopic Mass	602.25629
SMILES	COc1ccc(CN2C[C@@H](C)[C@H](OC)CN(C)C(=O)c3ccc(NC(=O)c4nc5ccccc5s4)cc3OC[C@@H]2C)cc1
InChI	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22+,29-/m1/s1
InChIKey	AXRPYCYFPRGHTO-UETOGOEVSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(5S,6R,9S)-5-methoxy-8-[(4-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide (CHEBI:111845) is a azamacrocycle (CHEBI:52898)
	N-[(5S,6R,9S)-5-methoxy-8-[(4-methoxyphenyl)methyl]-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide (CHEBI:111845) is a lactam (CHEBI:24995)

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