1.0 2010-04-08 22:11:02 UTC 2025-11-19 00:42:28 UTC FDB014031 1-Deoxynojirimycin Alkaloid from Morus subspecies 1-Deoxynojirimycin is found in fruits. (2R,3R,4R,5S)-2-(Hydroxymethyl)piperidine-3,4,5-triol 1-DEOXY-NOJIRIMYCIN 1-Deoxymannojirimycin 1-Deoxynojirimycin 1-deoxynojirimycin (DNJ) 1,5-Dideoxy-1,5-imino-D-glucitol, 9CI 1hxk 1oim Antibiotic S-GI Moranoline NOJ S-GI C6H13NO4 163.1717 163.084457909 2-(hydroxymethyl)piperidine-3,4,5-triol 1 deoxynojirimycin 19130-96-2 OCC1NCC(O)C(O)C1O InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2 LXBIFEVIBLOUGU-UHFFFAOYSA-N belongs to the class of organic compounds known as piperidines. Piperidines are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five carbon atoms. Piperidines Organic compounds Organoheterocyclic compounds Piperidines Aliphatic heteromonocyclic compounds 1,2-aminoalcohols Azacyclic compounds Dialkylamines Hydrocarbon derivatives Organopnictogen compounds Polyols Primary alcohols Secondary alcohols 1,2-aminoalcohol Alcohol Aliphatic heteromonocyclic compound Amine Azacycle Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Piperidine Polyol Primary alcohol Secondary alcohol Secondary aliphatic amine Secondary amine logp -2.22 ALOGPS logs 0.50 ALOGPS solubility 5.11e+02 g/l ALOGPS melting_point Mp 206° (195-197°) logp -2.9 ChemAxon pka_strongest_acidic 12.91 ChemAxon pka_strongest_basic 8.06 ChemAxon iupac 2-(hydroxymethyl)piperidine-3,4,5-triol ChemAxon average_mass 163.1717 ChemAxon mono_mass 163.084457909 ChemAxon smiles OCC1NCC(O)C(O)C1O ChemAxon formula C6H13NO4 ChemAxon inchi InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2 ChemAxon inchikey LXBIFEVIBLOUGU-UHFFFAOYSA-N ChemAxon polar_surface_area 92.95 ChemAxon refractivity 36.57 ChemAxon polarizability 15.85 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 5 ChemAxon donor_count 5 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 10544 Specdb::MsMs 10545 Specdb::MsMs 10546 Specdb::MsMs 17216 Specdb::MsMs 17217 Specdb::MsMs 17218 Specdb::MsMs 2327241 Specdb::MsMs 2327242 Specdb::MsMs 2327243 Specdb::MsMs 2612170 Specdb::MsMs 2612171 Specdb::MsMs 2612172 Specdb::NmrOneD 131118 Specdb::NmrOneD 131119 Specdb::NmrOneD 131120 Specdb::NmrOneD 131121 Specdb::NmrOneD 131122 Specdb::NmrOneD 131123 Specdb::NmrOneD 131124 Specdb::NmrOneD 131125 Specdb::NmrOneD 131126 Specdb::NmrOneD 131127 Specdb::NmrOneD 131128 Specdb::NmrOneD 131129 Specdb::NmrOneD 131130 Specdb::NmrOneD 131131 Specdb::NmrOneD 131132 Specdb::NmrOneD 131133 Specdb::NmrOneD 131134 Specdb::NmrOneD 131135 Specdb::NmrOneD 131136 Specdb::NmrOneD 131137 Specdb::CMs 14524 Specdb::CMs 44350 Specdb::CMs 120279 Specdb::CMs 121852 Specdb::CMs 128851 Specdb::CMs 173130 Specdb::CMs 861890 Specdb::CMs 861891 Specdb::CMs 861892 Specdb::CMs 861893 Specdb::CMs 861894 Specdb::CMs 861895 Specdb::CMs 861896 Specdb::CMs 861897 Specdb::CMs 861898 Specdb::CMs 861899 Specdb::CMs 861900 Specdb::CMs 861901 Specdb::CMs 861902 Specdb::CMs 861903 Specdb::CMs 861904 Specdb::CMs 861905 Specdb::CMs 861906 Specdb::CMs 861907 Specdb::CMs 861908 HMDB35359 #<Reference:0x000055ce2eaad488> Fruits Unknown generic