CHEBI:80974 - 2-Oxo-9-methylthiononanoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-Oxo-9-methylthiononanoic acid
ChEBI ID CHEBI:80974
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C10H18O3S
Net Charge 0
Average Mass 218.31300
Monoisotopic Mass 218.09767
InChI InChI=1S/C10H18O3S/c1-14-8-6-4-2-3-5-7-9(11)10(12)13/h2-8H2,1H3,(H,12,13)
InChIKey MJGXIOUQXYXGLP-UHFFFAOYSA-N
SMILES CSCCCCCCCC(=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-Oxo-9-methylthiononanoic acid (CHEBI:80974) is a oxo carboxylic acid (CHEBI:25754)
Synonym Source
9-Methylthio-2-nonanoic acid KEGG COMPOUND
Manual Xrefs Databases
C00007654 KNApSAcK
C17228 KEGG COMPOUND
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