1-[[(2R,3R)-9-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea (CHEBI:128889)

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CHEBI:128889 - 1-[[(2R,3R)-9-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

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ChEBI ID	CHEBI:128889
ChEBI Name	1-[[(2R,3R)-9-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea
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Downloads	Molfile

Formula	C27H38N4O5
Net Charge	0
Average Mass	498.624
Monoisotopic Mass	498.28422
SMILES	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(N(C)C)cc3CC(=O)N([C@@H](C)CO)C[C@H]2C)cc1
InChI	InChI=1S/C27H38N4O5/c1-18-15-31(19(2)17-32)26(33)14-20-13-22(29(3)4)9-12-24(20)36-25(18)16-30(5)27(34)28-21-7-10-23(35-6)11-8-21/h7-13,18-19,25,32H,14-17H2,1-6H3,(H,28,34)/t18-,19+,25+/m1/s1
InChIKey	ATOUFFMQMQIITO-WYEJZRMESA-N

ChEBI Ontology

Outgoing Relation(s)
	1-[[(2R,3R)-9-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea (CHEBI:128889) is a ureas (CHEBI:47857)

Manual Xrefs	Databases
LSM-40441	LINCS