CHEBI:83781 - (R)-tebuconazole

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ChEBI Name (R)-tebuconazole ChEBI ID CHEBI:83781 ChEBI ASCII Name (R)-tebuconazole Definition The (R)-enantiomer of 1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol. 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 C16H22ClN3O Net Charge 0 Average Mass 307.81800 Monoisotopic Mass 307.14514 InChI InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3/t16-/m0/s1 InChIKey PXMNMQRDXWABCY-INIZCTEOSA-N SMILES CC(C)(C)[C@](O)(CCc1ccc(Cl)cc1)Cn1cncn1 ChEBI Ontology Outgoing (R)-tebuconazole (CHEBI:83781) is a 1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol (CHEBI:83779) (R)-tebuconazole (CHEBI:83781) is enantiomer of (S)-tebuconazole (CHEBI:83780) Incoming tebuconazole (CHEBI:81781) has part (R)-tebuconazole (CHEBI:83781) (S)-tebuconazole (CHEBI:83780) is enantiomer of (R)-tebuconazole (CHEBI:83781) IUPAC Name (3R)-1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol Registry Number Type Source 5749275 Reaxys Registry Number Reaxys Last Modified 17 November 2014