CHEBI:83759 - (2S,3R)-epoxiconazole

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ChEBI Name (2S,3R)-epoxiconazole ChEBI ID CHEBI:83759 ChEBI ASCII Name (2S,3R)-epoxiconazole Definition The (2S,3R)-stereoisomer of 1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C17H13ClFN3O Net Charge 0 Average Mass 329.75600 Monoisotopic Mass 329.07312 InChI InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1 InChIKey ZMYFCFLJBGAQRS-IAGOWNOFSA-N SMILES Fc1ccc(cc1)[C@@]1(Cn2cncn2)O[C@@H]1c1ccccc1Cl ChEBI Ontology Outgoing (2S,3R)-epoxiconazole (CHEBI:83759) is a 1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole (CHEBI:83758) (2S,3R)-epoxiconazole (CHEBI:83759) is enantiomer of (2R,3S)-epoxiconazole (CHEBI:83761) Incoming epoxiconazole (CHEBI:4811) has part (2S,3R)-epoxiconazole (CHEBI:83759) (2R,3S)-epoxiconazole (CHEBI:83761) is enantiomer of (2S,3R)-epoxiconazole (CHEBI:83759) IUPAC Name 1-{[(2S,3R)-3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole Manual Xref Database C11229 KEGG COMPOUND View more database links Last Modified 18 November 2014