Molecular Identity
Isosorbide Dinitrate
[(3S,3aS,6R,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate
PubChem CID: 6883
Isosorbide dinitrate is a nitrate ester and a glucitol derivative. It has a role as a vasodilator agent and a nitric oxide donor.
2D Structure
Properties
C6H8N2O8
Molecular Formula
236.14
Molecular Weight
g/mol
236.0281
Exact Mass
Da
1.3
XLogP
Drug-like (Lipinski: < 5)
129
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
8
H-Bond Acceptors
268
Complexity
SMILES
Canonical SMILES
SMILES: C1C(C2C(O1)C(CO2)O[N+](=O)[O-])O[N+](=O)[O-]Isomeric SMILES
SMILES: C1[C@H]([C@@H]2[C@H](O1)[C@H](CO2)O[N+](=O)[O-])O[N+](=O)[O-]Synonyms(20)
ISOSORBIDE DINITRATE87-33-2IsordilSorbidnitrateSorbitrateSorbide nitrateNitrosorbideISDNDinitrosorbideIsoketDilatrate-SRCarvasinCedocardD-Isosorbide dinitrateSorbidilat
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Isosorbide Dinitrate
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