CHEBI:36658 - 6-methylsalicylate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-methylsalicylate
ChEBI ID CHEBI:36658
Definition A hydroxybenzoate that is obtained by removal of a proton from the carboxylic acid group of 6-methylsalicylic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12224, CHEBI:19648
Supplier Information
Download Molfile XML SDF
Formula C8H7O3
Net Charge -1
Average Mass 151.13938
Monoisotopic Mass 151.04007
InChI InChI=1S/C8H8O3/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4,9H,1H3,(H,10,11)/p-1
InChIKey HCJMNOSIAGSZBM-UHFFFAOYSA-M
SMILES Cc1cccc(O)c1C([O-])=O
ChEBI Ontology
Outgoing 6-methylsalicylate (CHEBI:36658) has functional parent salicylate (CHEBI:30762)
6-methylsalicylate (CHEBI:36658) is a hydroxybenzoate (CHEBI:24675)
6-methylsalicylate (CHEBI:36658) is conjugate base of 6-methylsalicylic acid (CHEBI:17637)
Incoming 6-methylsalicylic acid (CHEBI:17637) is conjugate acid of 6-methylsalicylate (CHEBI:36658)
IUPAC Name
2-hydroxy-6-methylbenzoate
Synonyms Sources
2,6-cresotate ChEBI
2-hydroxy-6-methylbenzoate ChEBI
6-hydroxy-o-toluate ChEBI
6-Methyl 2-hydroxybenzenecarboxylate KEGG COMPOUND
6-methylsalicylate UniProt
6-Methylsalicylate KEGG COMPOUND
Manual Xrefs Databases
C02657 KEGG COMPOUND
CPD-637 MetaCyc
View more database links
Registry Number Type Source
10342326 Reaxys Registry Number Reaxys
Last Modified
21 August 2014