CHEBI:6061 - isosorbide dinitrate

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ChEBI Name isosorbide dinitrate
ChEBI ID CHEBI:6061
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H8N2O8
Net Charge 0
Average Mass 236.13640
Monoisotopic Mass 236.028
InChI InChI=1S/C6H8N2O8/c9-7(10)15-3-1-13-6-4(16-8(11)12)2-14-5(3)6/h3-6H,1-2H2/t3-,4+,5-,6-/m1/s1
InChIKey MOYKHGMNXAOIAT-JGWLITMVSA-N
SMILES [H][C@]12OC[C@H](O[N+]([O-])=O)[C@@]1([H])OC[C@H]2O[N+]([O-])=O
Roles Classification
Chemical Role(s): nitric oxide donor
An agent, with unique chemical structure and biochemical requirements, which generates nitric oxide.
Application(s): vasodilator agent
A drug used to cause dilation of the blood vessels.
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ChEBI Ontology
Outgoing isosorbide dinitrate (CHEBI:6061) has role nitric oxide donor (CHEBI:50566)
isosorbide dinitrate (CHEBI:6061) has role vasodilator agent (CHEBI:35620)
isosorbide dinitrate (CHEBI:6061) is a glucitol derivative (CHEBI:63433)
isosorbide dinitrate (CHEBI:6061) is a nitrate ester (CHEBI:51080)
IUPAC Name
1,4:3,6-dianhydro-2,5-di-O-nitro-D-glucitol
INNs Sources
dinitrate dʼisosorbide ChemIDplus
dinitrato de isosorbida ChemIDplus
isosorbide dinitrate ChemIDplus
isosorbidi dinitras ChemIDplus
Synonyms Sources
1,4:3,6-Dianhydrosorbitol 2,5-dinitrate ChemIDplus
D-Isosorbide dinitrate ChemIDplus
Dianhydrosorbitol 2,5-dinitrate ChemIDplus
Dinitroisosorbide ChemIDplus
Dinitrosorbide ChemIDplus
Isosorbide 2,5-dinitrate ChemIDplus
Isosorbide dinitrate KEGG COMPOUND
Sorbide nitrate DrugBank
Sorbidnitrate DrugBank
Brand Names Sources
Carvasin DrugBank
Cedocard Retard DrugBank
Flindix DrugBank
Isoket DrugBank
Isorbid DrugBank
Isordil DrugBank
Nitrosorbide DrugBank
Sorbidilat DrugBank
Database Links Databases
1505 DrugCentral
C07456 KEGG COMPOUND
D00516 KEGG DRUG
DB00883 DrugBank
View more database links
Registry Numbers Types Sources
87-33-2 CAS Registry Number ChemIDplus
88225 Beilstein Registry Number Beilstein
Last Modified
22 February 2017