EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:3668 - Choline salicylate

Default Structure
ChEBI IDCHEBI:3668
ChEBI NameCholine salicylate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC5H14NO.C7H5O3
Net Charge0
Average Mass241.287
Monoisotopic Mass241.13141
SMILESC[N+](C)(C)CCO.O=C([O-])c1ccccc1O
InChIInChI=1S/C7H6O3.C5H14NO/c8-6-4-2-1-3-5(6)7(9)10;1-6(2,3)4-5-7/h1-4,8H,(H,9,10);7H,4-5H2,1-3H3/q;+1/p-1
InChIKeyUDKCHVLMFQVBAA-UHFFFAOYSA-M
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
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.
Application:
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.
ChEBI Ontology
Outgoing Relation(s)
Choline salicylate (CHEBI:3668) has functional parent salicylic acid (CHEBI:16914)
Choline salicylate (CHEBI:3668) has role analgesic (CHEBI:35480)
Choline salicylate (CHEBI:3668) is a hydroxybenzoic acid (CHEBI:24676)
INNs  Source
salicilato de colinaWHO MedNet
salicylate de cholineWHO MedNet
Synonyms  Source
Choline salicylateKEGG COMPOUND
Choline, salicylate (salt)ChEMBL
Choline salicylic acid saltChEMBL
Salicylic acid choline saltChEMBL
Salicylic acid, ion(1-), cholineChEMBL
Brand Name  Source
DinnefordsChEMBL
Manual XrefsDatabases
D00810KEGG DRUG
Registry NumbersSources
CAS:2016-36-6KEGG COMPOUND