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CHEBI:118863 - 1-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-[4-(trifluoromethyl)phenyl]urea

ChEBI IDCHEBI:118863
ChEBI Name1-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
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DownloadsMolfile
FormulaC21H26F3N3O4
Net Charge0
Average Mass441.450
Monoisotopic Mass441.18754
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO
InChIInChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18-/m1/s1
InChIKeyWYLNQZCZILOHII-FGTMMUONSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-[4-(trifluoromethyl)phenyl]urea (CHEBI:118863) is a ureas (CHEBI:47857)
Manual XrefsDatabases
LSM-30312LINCS