EMBL-EBI | Chemical Biology Resources | ChEBI

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

CHEBI:128458 - disodium cromoglycate

Default Structure
ChEBI IDCHEBI:128458
ChEBI Namedisodium cromoglycate
Stars
DefinitionAn organic sodium salt that is the disodium salt of cromoglycic acid.
Secondary ChEBI IDsCHEBI:3922, CHEBI:3923, CHEBI:106480
Last Modified4 March 2019
DownloadsMolfile
FormulaC23H14O11.2Na
Net Charge0
Average Mass512.334
Monoisotopic Mass512.03315
SMILESO=C([O-])c1cc(=O)c2c(OCC(O)COc3cccc4oc(C(=O)[O-])cc(=O)c34)cccc2o1.[Na+].[Na+]
InChIInChI=1S/C23H16O11.2Na/c24-11(9-31-14-3-1-5-16-20(14)12(25)7-18(33-16)22(27)28)10-32-15-4-2-6-17-21(15)13(26)8-19(34-17)23(29)30;;/h1-8,11,24H,9-10H2,(H,27,28)(H,29,30);;/q;2*+1/p-2
InChIKeyVLARUOGDXDTHEH-UHFFFAOYSA-L
Roles Classification
Biological Roles:
drug allergen  Any drug which causes the onset of an allergic reaction.
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.
Applications:
drug allergen  Any drug which causes the onset of an allergic reaction.
anti-asthmatic agent  Any compound that has anti-asthmatic effects.
ophthalmology drug  Any compound used for the treatment of eye conditions or eye diseases.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
anti-asthmatic drug  A drug used to treat asthma.
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)
disodium cromoglycate (CHEBI:128458) has part cromoglycate(2−) (CHEBI:59039)
disodium cromoglycate (CHEBI:128458) has role analgesic (CHEBI:35480)
disodium cromoglycate (CHEBI:128458) has role anti-asthmatic agent (CHEBI:65023)
disodium cromoglycate (CHEBI:128458) has role anti-asthmatic drug (CHEBI:49167)
disodium cromoglycate (CHEBI:128458) has role antineoplastic agent (CHEBI:35610)
disodium cromoglycate (CHEBI:128458) has role drug allergen (CHEBI:88188)
disodium cromoglycate (CHEBI:128458) has role ophthalmology drug (CHEBI:66981)
disodium cromoglycate (CHEBI:128458) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
disodium 5,5'-[(2-hydroxypropane-1,3-diyl)bis(oxy)]bis(4-oxo-4H-chromene-2-carboxylate)
Synonyms  Source
AstilynChEMBL
Cromoglicate sodiumChEMBL
Cromoglycate disodiumChemIDplus
cromolyn sodiumChEMBL
Cromolyn sodiumKEGG DRUG
Dinatrium salz von 1,3-bis-(2-carboxychromon-5-yloxy)-2-hydroxypropanChemIDplus
Brand Names  Source
AerocromChEMBL
AllercromChEMBL
AspireChEMBL
Brol-ezeChEMBL
CatacromChEMBL
ClariteyesChEMBL
Manual XrefsDatabases
D00526KEGG DRUG
Registry NumbersSources
Beilstein:3647577Beilstein
CAS:15826-37-6ChemIDplus
CAS:15826-37-6KEGG DRUG
Citations