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CHEBI:97883 - methyl 2-[(2S,3R,6S)-2-(hydroxymethyl)-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]-3,6-dihydro-2H-pyran-6-yl]acetate

ChEBI IDCHEBI:97883
ChEBI Namemethyl 2-[(2S,3R,6S)-2-(hydroxymethyl)-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]-3,6-dihydro-2H-pyran-6-yl]acetate
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FormulaC17H19F3N2O5
Net Charge0
Average Mass388.342
Monoisotopic Mass388.12461
SMILESCOC(=O)C[C@H]1C=C[C@@H](NC(=O)Nc2ccc(C(F)(F)F)cc2)[C@@H](CO)O1
InChIInChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m1/s1
InChIKeyPYGNPVIZRZQEAZ-MGPQQGTHSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl 2-[(2S,3R,6S)-2-(hydroxymethyl)-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]-3,6-dihydro-2H-pyran-6-yl]acetate (CHEBI:97883) is a ureas (CHEBI:47857)
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