N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[(4-pyridin-2-ylphenyl)methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]acetamide (CHEBI:98518)

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CHEBI:98518 - N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[(4-pyridin-2-ylphenyl)methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]acetamide

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ChEBI ID	CHEBI:98518
ChEBI Name	N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[(4-pyridin-2-ylphenyl)methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]acetamide
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Downloads	Molfile

Formula	C31H38N4O4
Net Charge	0
Average Mass	530.669
Monoisotopic Mass	530.28931
SMILES	CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccc(-c3ccccn3)cc2)C[C@H]1C
InChI	InChI=1S/C31H38N4O4/c1-21-17-35(18-24-9-11-25(12-10-24)28-8-6-7-15-32-28)22(2)20-39-29-16-26(33-23(3)36)13-14-27(29)31(37)34(4)19-30(21)38-5/h6-16,21-22,30H,17-20H2,1-5H3,(H,33,36)/t21-,22-,30-/m1/s1
InChIKey	ILITXRRNALRLLT-NPKFRGRUSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[(4-pyridin-2-ylphenyl)methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]acetamide (CHEBI:98518) is a azamacrocycle (CHEBI:52898)
	N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[(4-pyridin-2-ylphenyl)methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]acetamide (CHEBI:98518) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-9897	LINCS