CHEBI:82791 - (S)-metalaxyl

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (S)-metalaxyl
ChEBI ID CHEBI:82791
ChEBI ASCII Name (S)-metalaxyl
Definition A methyl N-(2,6-dimethylphenyl)-N-(methoxyacetyl)alaninate that is the less active S-enantiomer of metalaxyl.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C15H21NO4
Net Charge 0
Average Mass 279.33150
Monoisotopic Mass 279.14706
InChI InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m0/s1
InChIKey ZQEIXNIJLIKNTD-LBPRGKRZSA-N
SMILES COCC(=O)N([C@@H](C)C(=O)OC)c1c(C)cccc1C
ChEBI Ontology
Outgoing (S)-metalaxyl (CHEBI:82791) is a L-alanine derivative (CHEBI:83943)
(S)-metalaxyl (CHEBI:82791) is a methyl N-(2,6-dimethylphenyl)-N-(methoxyacetyl)alaninate (CHEBI:82790)
(S)-metalaxyl (CHEBI:82791) is enantiomer of metalaxyl-M (CHEBI:60607)
Incoming metalaxyl (CHEBI:6790) has part (S)-metalaxyl (CHEBI:82791)
metalaxyl-M (CHEBI:60607) is enantiomer of (S)-metalaxyl (CHEBI:82791)
IUPAC Name
methyl N-(2,6-dimethylphenyl)-N-(methoxyacetyl)-L-alaninate
Registry Number Type Source
8324516 Reaxys Registry Number Reaxys
Last Modified
08 January 2015