3-(3,5-dimethyl-4-isoxazolyl)-1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea (CHEBI:112459)

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CHEBI:112459 - 3-(3,5-dimethyl-4-isoxazolyl)-1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea

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ChEBI ID	CHEBI:112459
ChEBI Name	3-(3,5-dimethyl-4-isoxazolyl)-1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea
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Downloads	Molfile

Formula	C22H35N7O5
Net Charge	0
Average Mass	477.566
Monoisotopic Mass	477.26997
SMILES	Cc1noc(C)c1NC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N([C@H](C)CO)C[C@H]1C
InChI	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19+/m1/s1
InChIKey	RMZGJSLXUIRDMP-CLCXKQKWSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-(3,5-dimethyl-4-isoxazolyl)-1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea (CHEBI:112459) is a azamacrocycle (CHEBI:52898)
	3-(3,5-dimethyl-4-isoxazolyl)-1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea (CHEBI:112459) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-23871	LINCS