1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-(3-pyridinyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-phenylurea (CHEBI:96043)

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CHEBI:96043 - 1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-(3-pyridinyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-phenylurea

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ChEBI ID	CHEBI:96043
ChEBI Name	1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-(3-pyridinyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-phenylurea
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Formula	C27H31N5O4
Net Charge	0
Average Mass	489.576
Monoisotopic Mass	489.23760
SMILES	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(-c3cccnc3)cc2C1=O
InChI	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24-/m0/s1
InChIKey	BUQVOPHSTBMFAQ-GLDPYIMESA-N

ChEBI Ontology

Outgoing Relation(s)
	1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-(3-pyridinyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-phenylurea (CHEBI:96043) is a bipyridines (CHEBI:50511)

Manual Xrefs	Databases
LSM-7422	LINCS