3-(4-fluorophenyl)-1-[[(2R,3S)-8-(3-hydroxy-3-methylbut-1-ynyl)-5-[(2R)-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:113935)

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CHEBI:113935 - 3-(4-fluorophenyl)-1-[[(2R,3S)-8-(3-hydroxy-3-methylbut-1-ynyl)-5-[(2R)-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:113935
ChEBI Name	3-(4-fluorophenyl)-1-[[(2R,3S)-8-(3-hydroxy-3-methylbut-1-ynyl)-5-[(2R)-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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Downloads	Molfile

Formula	C27H33FN4O5
Net Charge	0
Average Mass	512.582
Monoisotopic Mass	512.24350
SMILES	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ncc(C#CC(C)(C)O)cc2C1=O
InChI	InChI=1S/C27H33FN4O5/c1-17-14-32(18(2)16-33)25(34)22-12-19(10-11-27(3,4)36)13-29-24(22)37-23(17)15-31(5)26(35)30-21-8-6-20(28)7-9-21/h6-9,12-13,17-18,23,33,36H,14-16H2,1-5H3,(H,30,35)/t17-,18+,23-/m0/s1
InChIKey	LSQXOCNKPAEEQI-IXFSTUDKSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-(4-fluorophenyl)-1-[[(2R,3S)-8-(3-hydroxy-3-methylbut-1-ynyl)-5-[(2R)-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:113935) is a ureas (CHEBI:47857)

Manual Xrefs	Databases
LSM-25367	LINCS