1.0 2010-04-08 22:10:06 UTC 2019-11-26 03:06:34 UTC FDB012323 2'-Deoxyinosine Isolated from Phaseolus vulgaris (kidney bean). 2'-Deoxyinosine is found in pulses, yellow wax bean, and green bean. 2-Deoxy-inosine 9-(2-Deoxy-b-D-erythro-pentofuranosyl)-1,9-dihydro-6H-purin-6-one 9-(2-Deoxy-b-D-erythro-pentofuranosyl)-9H-purin-6-ol 9-(2-Deoxy-b-D-erythro-pentofuranosyl)-hypoxanthine 9-(2-deoxy-beta-D-erythro-pentofuranosyl)-9H-purin-6-ol 9-(2-Deoxy-beta-D-erythro-pentofuranosyl)-hypoxanthine 9-(2-Deoxy-beta-delta-erythro-pentofuranosyl)-1,9-dihydro-6H-purin-6-one 9-(2-Deoxy-beta-delta-erythro-pentofuranosyl)-hypoxanthine 9-(2-Deoxy-β-D-erythro-pentofuranosyl)-9H-purin-6-ol 9-(2-Deoxyribofuranosyl)hypoxanthine D-Ino delta-Ino Deoxyinosine Hypoxanthine 2-deoxyriboside C10H12N4O4 252.23 252.085854882 9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-ol 2'-deoxy-inosine 890-38-0 OC[C@H]1O[C@H](C[C@@H]1O)N1C=NC2=C1N=CNC2=O InChI=1S/C10H12N4O4/c15-2-6-5(16)1-7(18-6)14-4-13-8-9(14)11-3-12-10(8)17/h3-7,15-16H,1-2H2,(H,11,12,17)/t5-,6+,7+/m0/s1 VGONTNSXDCQUGY-RRKCRQDMSA-N belongs to the class of organic compounds known as purine 2'-deoxyribonucleosides. Purine 2'-deoxyribonucleosides are compounds consisting of a purine linked to a ribose which lacks a hydroxyl group at position 2. Purine 2'-deoxyribonucleosides Organic compounds Nucleosides, nucleotides, and analogues Purine nucleosides Purine 2'-deoxyribonucleosides Aromatic heteropolycyclic compounds Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Hydroxypyrimidines Hypoxanthines N-substituted imidazoles Organonitrogen compounds Organopnictogen compounds Oxacyclic compounds Primary alcohols Secondary alcohols Tetrahydrofurans Alcohol Aromatic heteropolycyclic compound Azacycle Azole Heteroaromatic compound Hydrocarbon derivative Hydroxypyrimidine Hypoxanthine Imidazole Imidazopyrimidine N-substituted imidazole Organic nitrogen compound Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Primary alcohol Purine Purine 2'-deoxyribonucleoside Pyrimidine Secondary alcohol Tetrahydrofuran purine 2'-deoxyribonucleoside Solid logp -1.67 ALOGPS logs -1.40 ALOGPS solubility 1.01e+01 g/l ALOGPS melting_point Mp 218° dec. logp -0.66 ChemAxon pka_strongest_acidic 11.68 ChemAxon pka_strongest_basic -0.1 ChemAxon iupac 9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-ol ChemAxon average_mass 252.23 ChemAxon mono_mass 252.085854882 ChemAxon smiles OC[C@H]1O[C@H](C[C@@H]1O)N1C=NC2=C1N=CNC2=O ChemAxon formula C10H12N4O4 ChemAxon inchi InChI=1S/C10H12N4O4/c15-2-6-5(16)1-7(18-6)14-4-13-8-9(14)11-3-12-10(8)17/h3-7,15-16H,1-2H2,(H,11,12,17)/t5-,6+,7+/m0/s1 ChemAxon inchikey VGONTNSXDCQUGY-RRKCRQDMSA-N ChemAxon polar_surface_area 113.52 ChemAxon refractivity 58.97 ChemAxon polarizability 23.69 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 7 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Purine Metabolism SMP00050 map00230 Specdb::EiMs 916 Specdb::NmrTwoD 1126 Specdb::NmrOneD 1068 Specdb::NmrOneD 3378 Specdb::NmrOneD 4930 Specdb::NmrOneD 4931 Specdb::NmrOneD 5572 Specdb::NmrOneD 5573 Specdb::NmrOneD 5574 Specdb::NmrOneD 5575 Specdb::NmrOneD 5576 Specdb::NmrOneD 5577 Specdb::NmrOneD 5578 Specdb::NmrOneD 5579 Specdb::NmrOneD 5580 Specdb::NmrOneD 5581 Specdb::NmrOneD 5582 Specdb::NmrOneD 5583 Specdb::NmrOneD 5584 Specdb::NmrOneD 5585 Specdb::NmrOneD 5586 Specdb::NmrOneD 5587 Specdb::NmrOneD 5588 Specdb::NmrOneD 5589 Specdb::NmrOneD 5590 Specdb::NmrOneD 5591 Specdb::MsMs 114 Specdb::MsMs 115 Specdb::MsMs 116 Specdb::MsMs 179040 Specdb::MsMs 179041 Specdb::MsMs 179042 Specdb::MsMs 181365 Specdb::MsMs 181366 Specdb::MsMs 181367 Specdb::MsMs 2698092 Specdb::MsMs 2698093 Specdb::MsMs 2698094 Specdb::MsMs 2984243 Specdb::MsMs 2984244 Specdb::MsMs 2984245 Specdb::CMs 309 Specdb::CMs 310 Specdb::CMs 2027 Specdb::CMs 2877 Specdb::CMs 30423 Specdb::CMs 30424 Specdb::CMs 30981 Specdb::CMs 37280 Specdb::CMs 146686 Specdb::CMs 1049584 Specdb::CMs 1049586 Specdb::CMs 1049588 Specdb::CMs 1049590 Specdb::CMs 1049592 Specdb::CMs 1049593 Specdb::CMs 1049595 Specdb::CMs 1049598 Specdb::CMs 1049599 Specdb::CMs 1049602 Specdb::CMs 1049603 HMDB00071 28997 2ND #<Reference:0x000055ce325e45b0> #<Reference:0x000055ce325e43f8> #<Reference:0x000055ce325e4240> #<Reference:0x000055ce325e4088> #<Reference:0x000055ce325dff38> #<Reference:0x000055ce325dfd80> #<Reference:0x000055ce325dfbc8> Anatidae Type 1 specific Anatidae 8830 Beefalo Type 1 specific Bos taurus X Bison bison 297284 Bison Type 1 specific Bison bison 9901 Buffalo Type 1 specific Bubalus bubalis 89462 Cattle (Beef, Veal) Type 1 specific Bos taurus 9913 Chicken Type 1 specific Gallus gallus 9031 Columbidae (Dove, Pigeon) Type 1 specific Columbidae 8930 Deer Type 1 specific Cervidae 9850 Domestic goat Type 1 specific Capra aegagrus hircus 9925 Domestic pig Type 1 specific Sus scrofa domestica 9825 Elk Type 1 specific Cervus canadensis 1574408 Emu Type 1 specific Dromaius novaehollandiae 8790 European rabbit Type 1 specific Oryctolagus 9984 Green bean Type 1 specific Phaseolus vulgaris 3885 Greylag goose Type 1 specific Anser anser 8843 Guinea hen Type 1 specific Numida meleagris 8996 Horse Type 1 specific Equus caballus 9796 Mallard duck Type 1 specific Anas platyrhynchos 8839 Mountain hare Type 1 specific Lepus timidus 62621 Mule deer Type 1 specific Odocoileus 9871 Ostrich Type 1 specific Struthio camelus 8801 Pheasant Type 1 specific Phasianus colchicus 9054 Pulses Unknown generic Quail Type 1 specific Phasianidae 9005 Rabbit Type 1 specific Leporidae 9979 Rock ptarmigan Type 1 specific Lagopus muta 64668 Sheep (Mutton, Lamb) Type 1 specific Ovis aries 9940 Squab Type 1 specific Columba 8931 Turkey Type 1 specific Meleagris gallopavo 9103 Velvet duck Type 1 specific Melanitta fusca 371864 Wild boar Type 1 specific Sus scrofa 9823 Yellow wax bean Type 1 specific Phaseolus vulgaris 3885 Adenosine deaminase P00813 ADA Purine nucleoside phosphorylase P00491 PNP