1-[(5S,6S,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-phenylurea (CHEBI:112121)

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CHEBI:112121 - 1-[(5S,6S,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-phenylurea

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ChEBI ID	CHEBI:112121
ChEBI Name	1-[(5S,6S,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-phenylurea
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Formula	C27H36N4O6
Net Charge	0
Average Mass	512.607
Monoisotopic Mass	512.26348
SMILES	COCC(=O)N1C[C@H](C)[C@H](OC)CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C
InChI	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m0/s1
InChIKey	HLIQDYQETVADJC-AXHZCLLHSA-N

ChEBI Ontology

Outgoing Relation(s)
	1-[(5S,6S,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-phenylurea (CHEBI:112121) is a azamacrocycle (CHEBI:52898)
	1-[(5S,6S,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-phenylurea (CHEBI:112121) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-23533	LINCS