1.0 2016-10-03 18:22:14 UTC 2020-04-22 15:45:45 UTC BMDB0011648 BMDB11648 1-(beta-D-Ribofuranosyl)-1,4-dihydronicotinamide Reduced nicotinamide riboside 1-(b-D-Ribofuranosyl)-1,4-dihydronicotinamide 1-(Β-D-ribofuranosyl)-1,4-dihydronicotinamide C11H16N2O5 256.2551 256.105921632 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,4-dihydropyridine-3-carboxamide reduced nicotinamide riboside NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O InChI=1S/C11H16N2O5/c12-10(17)6-2-1-3-13(4-6)11-9(16)8(15)7(5-14)18-11/h1,3-4,7-9,11,14-16H,2,5H2,(H2,12,17)/t7-,8-,9-,11-/m1/s1 MAKBMGXNXXXBFE-TURQNECASA-N belongs to the class of organic compounds known as glycosylamines. Glycosylamines are compounds consisting of an amine with a beta-N-glycosidic bond to a carbohydrate, thus forming a cyclic hemiaminal ether bond (alpha-amino ether). Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Glycosylamines Azacyclic compounds Carbonyl compounds Dihydropyridines Enamines Hydrocarbon derivatives N-substituted nicotinamides Organic oxides Organopnictogen compounds Oxacyclic compounds Pentoses Primary alcohols Primary carboxylic acid amides Secondary alcohols Tetrahydrofurans Vinylogous amides Alcohol Aliphatic heteromonocyclic compound Azacycle Carbonyl group Carboxamide group Carboxylic acid derivative Dihydropyridine Enamine Hydrocarbon derivative Hydropyridine Monosaccharide N-glycosyl compound N-substituted nicotinamide Organic nitrogen compound Organic oxide Organoheterocyclic compound Organonitrogen compound Organopnictogen compound Oxacycle Pentose monosaccharide Primary alcohol Primary carboxylic acid amide Secondary alcohol Tetrahydrofuran Vinylogous amide Aliphatic heteromonocyclic compounds dihydropyridine pyridine nucleoside Solid logp -1.94 ALOGPS logs -0.50 ALOGPS logp -2.1 ChemAxon pka_strongest_acidic 12.56 ChemAxon pka_strongest_basic 3.89 ChemAxon iupac 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,4-dihydropyridine-3-carboxamide ChemAxon average_mass 256.2551 ChemAxon mono_mass 256.105921632 ChemAxon smiles NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O ChemAxon formula C11H16N2O5 ChemAxon inchi InChI=1S/C11H16N2O5/c12-10(17)6-2-1-3-13(4-6)11-9(16)8(15)7(5-14)18-11/h1,3-4,7-9,11,14-16H,2,5H2,(H2,12,17)/t7-,8-,9-,11-/m1/s1 ChemAxon inchikey MAKBMGXNXXXBFE-TURQNECASA-N ChemAxon polar_surface_area 116.25 ChemAxon refractivity 61.84 ChemAxon polarizability 24.92 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 6 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 2 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 16486 Specdb::CMs 39740 Specdb::CMs 133201 Specdb::CMs 140935 Specdb::MsMs 302425 Specdb::MsMs 302426 Specdb::MsMs 302427 Specdb::MsMs 345151 Specdb::MsMs 345152 Specdb::MsMs 345153 Specdb::MsMs 2704703 Specdb::MsMs 2704704 Specdb::MsMs 2704705 Specdb::MsMs 3004269 Specdb::MsMs 3004270 Specdb::MsMs 3004271 Specdb::NmrOneD 93792 Specdb::NmrOneD 93793 Specdb::NmrOneD 93794 Specdb::NmrOneD 93795 Specdb::NmrOneD 93796 Specdb::NmrOneD 93797 Specdb::NmrOneD 93798 Specdb::NmrOneD 93799 Specdb::NmrOneD 93800 Specdb::NmrOneD 93801 Specdb::NmrOneD 93802 Specdb::NmrOneD 93803 Specdb::NmrOneD 93804 Specdb::NmrOneD 93805 Specdb::NmrOneD 93806 Specdb::NmrOneD 93807 Specdb::NmrOneD 93808 Specdb::NmrOneD 93809 Specdb::NmrOneD 93810 Specdb::NmrOneD 93811 FDB028341 C15497 9681931 11507134 55458 CPD-7229