CHEBI:31832 - methyl salicylate

ChEBI IDCHEBI:31832
ChEBI Namemethyl salicylate
Stars
DefinitionA benzoate ester that is the methyl ester of salicylic acid.
Last Modified8 July 2022
DownloadsMolfile
FormulaC8H8O3
Net Charge0
Average Mass152.149
Monoisotopic Mass152.04734
SMILESCOC(=O)c1ccccc1O
InChIInChI=1S/C8H8O3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,9H,1H3
InChIKeyOSWPMRLSEDHDFF-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
insect attractant  A chemical that attracts insects.
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
Applications:
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
vulnerary  A drug used in treating and healing of wounds.
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
ChEBI Ontology
Outgoing Relation(s)
methyl salicylate (CHEBI:31832) has functional parent salicylic acid (CHEBI:16914)
methyl salicylate (CHEBI:31832) has role analgesic (CHEBI:35480)
methyl salicylate (CHEBI:31832) has role anti-inflammatory agent (CHEBI:67079)
methyl salicylate (CHEBI:31832) has role flavouring agent (CHEBI:35617)
methyl salicylate (CHEBI:31832) has role insect attractant (CHEBI:24850)
methyl salicylate (CHEBI:31832) has role metabolite (CHEBI:25212)
methyl salicylate (CHEBI:31832) has role vulnerary (CHEBI:73336)
methyl salicylate (CHEBI:31832) is a benzoate ester (CHEBI:36054)
methyl salicylate (CHEBI:31832) is a methyl ester (CHEBI:25248)
methyl salicylate (CHEBI:31832) is a salicylates (CHEBI:26596)
Synonyms  Source
2-CarbomethoxyphenolChemIDplus
2-Hydroxybenzoic acid methyl esterChemIDplus
2-(Methoxycarbonyl)phenolChemIDplus
Betula oilChemIDplus
Fema no. 2154ChEMBL
FEMA NO. 2745ChEMBL
Brand Names  Source
AspellinChEMBL
BalmosaChEMBL
Bengue's balsamChEMBL
Deep heatChEMBL
DubamChEMBL
Gppe linChEMBL
UniProt Name  Source
methyl salicylateUniProt
Manual XrefsDatabases
4245DrugCentral
C00030767KNApSAcK
C12305KEGG COMPOUND
D01087KEGG DRUG
Methyl_salicylateWikipedia
Registry NumbersSources
Reaxys:971516Reaxys
CAS:119-36-8ChemIDplus
CAS:119-36-8KEGG COMPOUND
CAS:119-36-8NIST Chemistry WebBook
Citations