3-(1,3-benzodioxol-5-yl)-1-[[(2R,3R)-8-bromo-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea (CHEBI:106339)

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CHEBI:106339 - 3-(1,3-benzodioxol-5-yl)-1-[[(2R,3R)-8-bromo-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea

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ChEBI ID	CHEBI:106339
ChEBI Name	3-(1,3-benzodioxol-5-yl)-1-[[(2R,3R)-8-bromo-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea
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Formula	C23H27BrN4O6
Net Charge	0
Average Mass	535.395
Monoisotopic Mass	534.11140
SMILES	C[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(Br)cnc2O[C@H]1CN(C)C(=O)Nc1ccc2c(c1)OCO2
InChI	InChI=1S/C23H27BrN4O6/c1-13-9-28(14(2)11-29)22(30)17-6-15(24)8-25-21(17)34-20(13)10-27(3)23(31)26-16-4-5-18-19(7-16)33-12-32-18/h4-8,13-14,20,29H,9-12H2,1-3H3,(H,26,31)/t13-,14+,20+/m1/s1
InChIKey	SIKYFMKLFHRFBE-CKNLXJGOSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-(1,3-benzodioxol-5-yl)-1-[[(2R,3R)-8-bromo-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea (CHEBI:106339) is a benzodioxoles (CHEBI:38298)

Manual Xrefs	Databases
LSM-17699	LINCS