3-(4-fluorophenyl)-1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea (CHEBI:113940)

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CHEBI:113940 - 3-(4-fluorophenyl)-1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-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:113940
ChEBI Name	3-(4-fluorophenyl)-1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-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	C29H33FN4O5
Net Charge	0
Average Mass	536.604
Monoisotopic Mass	536.24350
SMILES	COc1ccc(-c2cnc3c(c2)C(=O)N([C@H](C)CO)C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)O3)cc1
InChI	InChI=1S/C29H33FN4O5/c1-18-15-34(19(2)17-35)28(36)25-13-21(20-5-11-24(38-4)12-6-20)14-31-27(25)39-26(18)16-33(3)29(37)32-23-9-7-22(30)8-10-23/h5-14,18-19,26,35H,15-17H2,1-4H3,(H,32,37)/t18-,19+,26-/m0/s1
InChIKey	DGOYOBOOQCXKTC-ANSQWYIGSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-(4-fluorophenyl)-1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methylurea (CHEBI:113940) is a phenylpyridine (CHEBI:38193)

Manual Xrefs	Databases
LSM-25372	LINCS