3-(2,5-difluorophenyl)-1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(3-methoxyprop-1-ynyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea (CHEBI:96290)

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CHEBI:96290 - 3-(2,5-difluorophenyl)-1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(3-methoxyprop-1-ynyl)-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:96290
ChEBI Name	3-(2,5-difluorophenyl)-1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(3-methoxyprop-1-ynyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea
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Downloads	Molfile

Formula	C26H30F2N4O5
Net Charge	0
Average Mass	516.545
Monoisotopic Mass	516.21843
SMILES	COCC#Cc1cnc2c(c1)C(=O)N([C@H](C)CO)C[C@H](C)[C@@H](CN(C)C(=O)Nc1cc(F)ccc1F)O2
InChI	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23+/m0/s1
InChIKey	SYMAGNSCDPNOSH-YGKZAACZSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-(2,5-difluorophenyl)-1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(3-methoxyprop-1-ynyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea (CHEBI:96290) is a ureas (CHEBI:47857)

Manual Xrefs	Databases
LSM-7669	LINCS