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CHEBI:6062 - isosorbide mononitrate

ChEBI IDCHEBI:6062
ChEBI Nameisosorbide mononitrate
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC6H9NO6
Net Charge0
Average Mass191.139
Monoisotopic Mass191.04299
SMILES[H][C@]12OC[C@@H](O[N+](=O)[O-])[C@@]1([H])OC[C@@H]2O
InChIInChI=1S/C6H9NO6/c8-3-1-11-6-4(13-7(9)10)2-12-5(3)6/h3-6,8H,1-2H2/t3-,4+,5+,6+/m0/s1
InChIKeyYWXYYJSYQOXTPL-SLPGGIOYSA-N
Roles Classification
Chemical Role:
nitric oxide donor  An agent, with unique chemical structure and biochemical requirements, which generates nitric oxide.
Application:
vasodilator agent  A drug used to cause dilation of the blood vessels.
ChEBI Ontology
Outgoing Relation(s)
isosorbide mononitrate (CHEBI:6062) has role nitric oxide donor (CHEBI:50566)
isosorbide mononitrate (CHEBI:6062) has role vasodilator agent (CHEBI:35620)
isosorbide mononitrate (CHEBI:6062) is a glucitol derivative (CHEBI:63433)
isosorbide mononitrate (CHEBI:6062) is a nitrate ester (CHEBI:51080)
IUPAC Name 
1,4:3,6-dianhydro-5-O-nitro-D-glucitol
INNs  Source
mononitrato de isosorbidaChemIDplus
mononitrate d'isosorbideChemIDplus
isosorbidi mononitrasChemIDplus
isosorbide mononitrateChemIDplus
Synonyms  Source
Isosorbide mononitrateKEGG COMPOUND
MonosorbitrateDrugBank
Brand Names  Source
CoranginDrugBank
DurideDrugBank
ElantanDrugBank
ImdurDrugBank
ImtrateDrugBank
IsmexinDrugBank
Manual XrefsDatabases
DB01020DrugBank
D00630KEGG DRUG
LSM-5883LINCS
1506DrugCentral
Registry NumbersSources
Beilstein:5851319Beilstein
CAS:16051-77-7ChemIDplus