CHEBI:91159 - 8-(methylthio)octylamine

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ChEBI Name 8-(methylthio)octylamine
ChEBI ID CHEBI:91159
Definition A primary amino compound that is octylamine in which one of the methyl hydrogens at position 8 has been replaced by a methylthio group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H21NS
Net Charge 0
Average Mass 175.336
Monoisotopic Mass 175.13947
InChI InChI=1S/C9H21NS/c1-11-9-7-5-3-2-4-6-8-10/h2-10H2,1H3
InChIKey FBFJELLIZHWAOM-UHFFFAOYSA-N
SMILES C(CCCCSC)CCCN
Metabolite of Species Details
Arabidopsis thaliana (NCBI:txid3702) Found in root (BTO:0001188). See: PubMed
Arabidopsis thaliana (NCBI:txid3702) Found in root (BTO:0001188). See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 8-(methylthio)octylamine (CHEBI:91159) has role plant metabolite (CHEBI:76924)
8-(methylthio)octylamine (CHEBI:91159) is a aliphatic sulfide (CHEBI:22327)
8-(methylthio)octylamine (CHEBI:91159) is a primary amino compound (CHEBI:50994)
IUPAC Name
8-(methylsulfanyl)octan-1-amine
Synonyms Sources
8-(methylsulfanyl)octylamine ChEBI
8-MeS-octyl-NH2 ChEBI
8-methylsulfanyloctylamine ChEBI
8-methylthiooctylamine ChEBI
Registry Number Type Source
1737554 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
25457500 PubMed citation Europe PMC
Last Modified
05 July 2016