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Isosorbide Dinitrate

PubChem CID: 6883

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Compound Synonyms ISOSORBIDE DINITRATE, 87-33-2, Sorbidnitrate, Isordil, Sorbide nitrate, Dinitrosorbide, Sorbitrate, Dilatrate-SR, Nitrosorbide, Carvasin, Sorbidilat, Vascardin, Flindix, Isoket, Isorbid, ISDN, Claodical, Corosorbide, Nitrosorbid, Nitrosorbon, Sorbangil, Vasodilat, Vasorbate, Carvanil, Cedocard, Cornilat, Coronex, Difutrat, Harrical, Isotrate, Korodil, Lomilan, Myorexon, Resoidan, Rigedal, Sorbislo, Sorbonit, Sorquad, Tinidil, Cardis, Emoper, Maycor, Nosim, Xanyl, Sorbide, dinitrate, Isordil Tembids, Rifloc Retard, D-Isosorbide dinitrate, Dilatrate, Iso-Bid, Dinitroisosorbide, Cardio 10, Astridine, Isochron, Dianhydrosorbitol 2,5-dinitrate, Isosorbide 2,5-dinitrate, Dignionitrat, Sorbidinitrate, Angidil, Corovliss, Diniket, Disorlon, Isodinit, Langoran, Laserdil, Sorbide, Sorquat, Sorbidi nitras, EureCor, Dilatrate SR, Isosorbidi nitras, Iso-Puren, Dinitrate d'isosorbide, Iso-Mack, IBD 20, Dinitrato de isosorbida, Isosorbidi dinitras, Sorate-5, Isostat, Sorate-10, Sorbide T.D., Cedocard Retard, D-Glucitol, 1,4:3,6-dianhydro-, dinitrate, 1,4:3,6-Dianhydrosorbitol 2,5-dinitrate, Isomannide-dinitrate, SST-101, 1,4:3,6-Dianhydro-D-glucitol dinitrate, CCRIS 1910, HSDB 3417, Isosorbidi dinitras [INN-Latin], EINECS 201-740-9, Dinitrate d'isosorbide [INN-French], NSC 80038, NSC-80038, Dinitrato de isosorbida [INN-Spanish], CHEBI:6061, UNII-IA7306519N, NSC80038, Glucitol, 1,4:3,6-dianhydro-, dinitrate, D-, IA7306519N, Isomak R, [(3S,3aS,6R,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate, Cardonit 40, DTXSID0045832, Frandol, C01DA08, EC 201-740-9, 1,4:3,6-dianhydro-2,5-di-O-nitro-D-glucitol, (3R,3aS,6S,6aS)-6-(nitrooxy)-hexahydrofuro[3,2-b]furan-3-yl nitrate, Isoket retard 40, ISD, Isoket Retard 120, BIDIL COMPONENT ISOSORBIDE DINITRATE, Isosorbide dinitrate [USAN:USP:INN:BAN:JAN], Isosorbide dinitrato, Dinitrate, Isosorbide, Isosorbide dinitrato [DCIT], DTXCID8025832, 1246815-45-1, Isosorbidi dinitras (INN-Latin), Dinitrate d'isosorbide (INN-French), ISOSORBIDE DINITRATE (MART.), ISOSORBIDE DINITRATE [MART.], Dinitrato de isosorbida (INN-Spanish), TYB 3215, Diluted isosorbide dinitrate, SDM No. 40, SDM No. 50, SMR000857256, Isordil (TN), ISOSORBIDE DINITRATE (USP IMPURITY), ISOSORBIDE DINITRATE [USP IMPURITY], Dilatrate-sr (TN), Isosorbide dinitrate (USAN:USP:INN:BAN:JAN), SR-05000001658, UN2907, IsordilTitradose, (3R,3aS,6S,6aS)-hexahydrofuro[3,2-b]furan-3,6-diyl dinitrate, CAS-87-33-2, Prestwick_81, NCGC00094703-01, isosorbide-dinitrate, MFCD00868238, Spectrum_000163, 1,4:3, 6-Dianhydro-D-glucitol dinitrate, Prestwick0_000714, Prestwick1_000714, Prestwick2_000714, Prestwick3_000714, Spectrum2_001069, Spectrum3_000600, Spectrum4_000025, Spectrum5_001057, 1,4:3,6-Dianhydrosorbitol 2, 5-dinitrate, Isosorbide Dinitrate,(S), Isosorbidi dinitras dilutes, Isosorbidi dinitras dilutus, Diluted-isosorbide dinitrate, SCHEMBL8253, CHEMBL6622, BSPBio_000927, BSPBio_002080, Isosorbide dinitrate, diluted, KBioGR_000429, KBioSS_000643, MLS001333561, MLS001333562, DivK1c_000436, SPECTRUM1500358, Isosorbide dinitrate, diluted-, SPBio_001058, SPBio_002848, Diluted isosorbide dinitrate rs, BPBio1_001021, GTPL7051, Isosorbide dinitrate (Standard), HMS501F18, HY-B1409R, KBio1_000436, KBio2_000643, KBio2_003211, KBio2_005779, KBio3_001580, ISOSORBIDE DINITRATE [MI], MOYKHGMNXAOIAT-JGWLITMVSA-N, NINDS_000436, HMS1570O09, HMS1920H15, HMS2091P05, HMS2097O09, HMS2230C09, HMS3714O09, ISOSORBIDE DINITRATE [INN], ISOSORBIDE DINITRATE [JAN], Pharmakon1600-01500358, ISOSORBIDE DINITRATE [HSDB], ISOSORBIDE DINITRATE [USAN], HY-B1409, 1,6-Dianhydro-D-glucitol dinitrate, ISOSORBIDE DINITRATE [VANDF], Tox21_111317, CCG-40110, NSC757080, 1,6-Dianhydrosorbitol 2,5-dinitrate, ISOSORBIDE DINITRATE [WHO-DD], AKOS015895227, AKOS015960761, AKOS015994784, Tox21_111317_1, DB00883, GS-6631, Isosorbide dinitrate (JP18/USP/INN), MI09907, NSC-757080, IDI1_000436, NCGC00178830-01, NCGC00178830-02, NCGC00178830-05, AC-12153, D-Glucitol,4:3,6-dianhydro-, dinitrate, ISOSORBIDE DINITRATE [ORANGE BOOK], SBI-0051421.P003, AB00513900, CS-0013129, DILUTED-ISOSORBIDE DINITRATE [WHO-IP], Glucitol,4:3,6-dianhydro-, dinitrate, D-, NS00001490, ISOSORBIDE DINITRATE COMPONENT OF BIDIL, C07456, D00516, EN300-222758, H10018, AB00052026_07, Glucitol, 1,4:3, 6-dianhydro-, dinitrate, D-, ISDN, 1,4:3,6-Dianhydro-2,5-dinitro-D-glucitol, ISOSORBIDI DINITRAS DILUTUS [WHO-IP LATIN], Q179748, SR-05000001658-1, SR-05000001658-3, SR-05000001658-5, BRD-K55853390-001-12-4, BRD-K55853390-001-13-2, Z2044782386, ISOSORBIDE MONONITRATE, DILUTED IMPURITY B [EP IMPURITY], Isosorbide dinitrate - 60% lactose and 40% Isosorbide dinitrate, (3S,3aS,6R,6aS)-6-(nitrooxy)-hexahydrofuro[3,2-b]furan-3-yl nitrate, [(3R,3aS,6S,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate, [(3S,3aS,6R,6aS)-6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[2,3-d]furan-3-yl] nitrate, 201-740-9, 54650-95-2
Topological Polar Surface Area 129.0
Hydrogen Bond Donor Count 0.0
Heavy Atom Count 16.0
Isotope Atom Count 0.0
Molecular Complexity 268.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 4.0
Uniprot Id P00811, n.a., Q9Y6L6, Q9NPD5, Q03431, P0DTD1, P10275
Iupac Name [(3S,3aS,6R,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate
Prediction Hob 1.0
Xlogp 1.3
Molecular Formula C6H8N2O8
Prediction Swissadme 0.0
Inchi Key MOYKHGMNXAOIAT-JGWLITMVSA-N
Fcsp3 1.0
Logs -2.589
Rotatable Bond Count 2.0
Logd 1.667
Compound Name Isosorbide Dinitrate
Prediction Hob Swissadme 0.0
Exact Mass 236.028
Formal Charge 0.0
Monoisotopic Mass 236.028
Hydrogen Bond Acceptor Count 8.0
Molecular Weight 236.14
Covalent Unit Count 1.0
Total Atom Stereocenter Count 4.0
Total Bond Stereocenter Count 0.0
Esol -1.8653431999999996
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
Smiles C1[C@H]([C@@H]2[C@H](O1)[C@H](CO2)O[N+](=O)[O-])O[N+](=O)[O-]
Nring 2.0
Defined Bond Stereocenter Count 0.0