1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea (CHEBI:108724)

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CHEBI:108724 - 1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea

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ChEBI ID	CHEBI:108724
ChEBI Name	1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
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Formula	C27H32N4O4
Net Charge	0
Average Mass	476.577
Monoisotopic Mass	476.24236
SMILES	CNC[C@H]1Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C(=O)N([C@H](C)CO)C[C@H]1C
InChI	InChI=1S/C27H32N4O4/c1-17-15-31(18(2)16-32)26(33)21-11-7-13-23(25(21)35-24(17)14-28-3)30-27(34)29-22-12-6-9-19-8-4-5-10-20(19)22/h4-13,17-18,24,28,32H,14-16H2,1-3H3,(H2,29,30,34)/t17-,18-,24-/m1/s1
InChIKey	KUARZOKVBLHXEU-QZTZHPFYSA-N

ChEBI Ontology

Outgoing Relation(s)
	1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea (CHEBI:108724) is a naphthalenes (CHEBI:25477)

Manual Xrefs	Databases
LSM-20123	LINCS