3-(4-fluorophenyl)-1-[(2R)-1-hydroxypropan-2-yl]-1-[(2R,3R)-3-methoxy-2-methyl-4-[methyl-[[4-(2-pyridinyl)phenyl]methyl]amino]butyl]urea (CHEBI:101172)

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CHEBI:101172 - 3-(4-fluorophenyl)-1-[(2R)-1-hydroxypropan-2-yl]-1-[(2R,3R)-3-methoxy-2-methyl-4-[methyl-[[4-(2-pyridinyl)phenyl]methyl]amino]butyl]urea

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ChEBI ID	CHEBI:101172
ChEBI Name	3-(4-fluorophenyl)-1-[(2R)-1-hydroxypropan-2-yl]-1-[(2R,3R)-3-methoxy-2-methyl-4-[methyl-[[4-(2-pyridinyl)phenyl]methyl]amino]butyl]urea
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Downloads	Molfile

Formula	C29H37FN4O3
Net Charge	0
Average Mass	508.638
Monoisotopic Mass	508.28497
SMILES	CO[C@@H](CN(C)Cc1ccc(-c2ccccn2)cc1)[C@H](C)CN(C(=O)Nc1ccc(F)cc1)[C@H](C)CO
InChI	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28+/m1/s1
InChIKey	XSSRKRLNCLGOQF-XJGOYTCSSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-(4-fluorophenyl)-1-[(2R)-1-hydroxypropan-2-yl]-1-[(2R,3R)-3-methoxy-2-methyl-4-[methyl-[[4-(2-pyridinyl)phenyl]methyl]amino]butyl]urea (CHEBI:101172) is a phenylpyridine (CHEBI:38193)

Manual Xrefs	Databases
LSM-12541	LINCS