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CHEBI:91157 - 9-(methylsulfinyl)nonamide

ChEBI IDCHEBI:91157
ChEBI Name9-(methylsulfinyl)nonamide
Stars
DefinitionA monocarboxylic acid amide that is nonanamide acid in which one of the methyl hydrogens at position 9 has been replaced by a methylsulfinyl group.
Last Modified5 July 2016
Submittermwilliams
DownloadsMolfile
FormulaC10H21NO2S
Net Charge0
Average Mass219.350
Monoisotopic Mass219.12930
SMILESCS(=O)CCCCCCCCC(N)=O
InChIInChI=1S/C10H21NO2S/c1-14(13)9-7-5-3-2-4-6-8-10(11)12/h2-9H2,1H3,(H2,11,12)
InChIKeyVMPLEBOKYLVHTO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702)
root (BTO:0001188) PubMed (25457500)
root (BTO:0001188) MetaboLights (MTBLS160)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
9-(methylsulfinyl)nonamide (CHEBI:91157) has functional parent nonanoic acid (CHEBI:29019)
9-(methylsulfinyl)nonamide (CHEBI:91157) has role plant metabolite (CHEBI:76924)
9-(methylsulfinyl)nonamide (CHEBI:91157) is a monocarboxylic acid amide (CHEBI:29347)
9-(methylsulfinyl)nonamide (CHEBI:91157) is a sulfoxide (CHEBI:22063)
IUPAC Name 
9-(methanesulfinyl)nonanamide
Synonym  Source
8-MeSO-octyl-CONH2ChEBI
Registry NumbersSources
Reaxys:28063959Reaxys
Citations