1.0 2011-09-21 01:53:20 UTC 2017-04-03 05:02:20 UTC FDB029289 UDP-N-acetyl-D-mannosamine UDP-N-acetyl-D-mannosamine is involved in teichoic acid (poly-glycerol) biosynthesis pathway and enterobacterial common antigen biosynthesis pathway. It serves as both enzymatic reactants and products in those two pathways. In teichoic acid (poly-glycerol) biosynthesis pathway, UDP-N-acetyl-mannosamine is synthesized from UDP-N-acetyl-glocasamine by UDP-N-acetylglucosamine 2-epimerase, encoded by the mnaA gene [HMDB] Uridine diate N-acetylgalactosamine Uridine diphosphate n-acetylgalactosamine Uridine-diate-N-acetylgalactosamine Uridine-diphosphate-n-acetylgalactosamine Uridine-diphosphate-n-acetylglucosamine C17H27N3O17P2 607.3537 607.081569477 [({[(2S,3R,4S,5S)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]({[(3R,4S,5R,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})phosphinic acid {[(2S,3R,4S,5S)-5-(2,4-dioxo-3H-pyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy([(3R,4S,5R,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy)phosphinic acid 528-04-1 CC(=O)N[C@@H]1[C@H](O)[C@@H](O)[C@H](CO)OC1OP(O)(=O)OP(O)(=O)OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N1C=CC(=O)NC1=O InChI=1S/C17H27N3O17P2/c1-6(22)18-10-13(26)11(24)7(4-21)35-16(10)36-39(31,32)37-38(29,30)33-5-8-12(25)14(27)15(34-8)20-3-2-9(23)19-17(20)28/h2-3,7-8,10-16,21,24-27H,4-5H2,1H3,(H,18,22)(H,29,30)(H,31,32)(H,19,23,28)/t7-,8-,10+,11-,12-,13-,14-,15-,16?/m0/s1 LFTYTUAZOPRMMI-IUPDHGCPSA-N belongs to the class of organic compounds known as pyrimidine nucleotide sugars. These are pyrimidine nucleotides bound to a saccharide derivative through the terminal phosphate group. Pyrimidine nucleotide sugars Organic compounds Nucleosides, nucleotides, and analogues Pyrimidine nucleotides Pyrimidine nucleotide sugars Aromatic heteromonocyclic compounds Acetamides Azacyclic compounds Carbonyl compounds Glycosylamines Heteroaromatic compounds Hydrocarbon derivatives Hydropyrimidines Lactams Monoalkyl phosphates Monosaccharide phosphates N-acyl-alpha-hexosamines Organic oxides Organic pyrophosphates Organonitrogen compounds Organopnictogen compounds Oxacyclic compounds Oxanes Pentose phosphates Primary alcohols Pyrimidine ribonucleoside diphosphates Pyrimidones Secondary alcohols Secondary carboxylic acid amides Tetrahydrofurans Ureas Vinylogous amides Acetamide Alcohol Alkyl phosphate Aromatic heteromonocyclic compound Azacycle Carbonyl group Carboxamide group Carboxylic acid derivative Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydropyrimidine Lactam Monoalkyl phosphate Monosaccharide Monosaccharide phosphate N-acyl-alpha-hexosamine N-glycosyl compound Organic nitrogen compound Organic oxide Organic oxygen compound Organic phosphoric acid derivative Organic pyrophosphate Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Oxane Pentose phosphate Pentose-5-phosphate Phosphoric acid ester Primary alcohol Pyrimidine Pyrimidine nucleotide sugar Pyrimidine ribonucleoside diphosphate Pyrimidone Secondary alcohol Secondary carboxylic acid amide Tetrahydrofuran Urea Vinylogous amide Solid logp -1.41 ALOGPS logs -1.72 ALOGPS solubility 1.14e+01 g/l ALOGPS logp -5.3 ChemAxon pka_strongest_acidic 1.74 ChemAxon pka_strongest_basic -3.5 ChemAxon iupac [({[(2S,3R,4S,5S)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]({[(3R,4S,5R,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})phosphinic acid ChemAxon average_mass 607.3537 ChemAxon mono_mass 607.081569477 ChemAxon smiles CC(=O)N[C@@H]1[C@H](O)[C@@H](O)[C@H](CO)OC1OP(O)(=O)OP(O)(=O)OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N1C=CC(=O)NC1=O ChemAxon formula C17H27N3O17P2 ChemAxon inchi InChI=1S/C17H27N3O17P2/c1-6(22)18-10-13(26)11(24)7(4-21)35-16(10)36-39(31,32)37-38(29,30)33-5-8-12(25)14(27)15(34-8)20-3-2-9(23)19-17(20)28/h2-3,7-8,10-16,21,24-27H,4-5H2,1H3,(H,18,22)(H,29,30)(H,31,32)(H,19,23,28)/t7-,8-,10+,11-,12-,13-,14-,15-,16?/m0/s1 ChemAxon inchikey LFTYTUAZOPRMMI-IUPDHGCPSA-N ChemAxon polar_surface_area 300.41 ChemAxon refractivity 117.56 ChemAxon polarizability 51.15 ChemAxon rotatable_bond_count 10 ChemAxon acceptor_count 14 ChemAxon donor_count 9 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 26472 Specdb::CMs 40053 Specdb::CMs 480783 Specdb::CMs 480784 Specdb::CMs 480785 Specdb::CMs 480786 Specdb::CMs 480787 Specdb::CMs 480788 Specdb::CMs 480789 Specdb::CMs 480790 Specdb::CMs 480791 Specdb::CMs 480792 Specdb::CMs 480793 Specdb::CMs 480794 Specdb::CMs 480795 Specdb::CMs 480796 Specdb::CMs 480797 Specdb::CMs 480798 Specdb::CMs 480799 Specdb::CMs 480800 Specdb::CMs 480801 Specdb::CMs 480802 Specdb::CMs 480803 Specdb::CMs 480804 Specdb::CMs 480805 Specdb::NmrOneD 11842 Specdb::NmrOneD 11843 Specdb::NmrOneD 11844 Specdb::NmrOneD 11845 Specdb::NmrOneD 11846 Specdb::NmrOneD 11847 Specdb::NmrOneD 11848 Specdb::NmrOneD 11849 Specdb::NmrOneD 11850 Specdb::NmrOneD 11851 Specdb::NmrOneD 11852 Specdb::NmrOneD 11853 Specdb::NmrOneD 11854 Specdb::NmrOneD 11855 Specdb::NmrOneD 11856 Specdb::NmrOneD 11857 Specdb::NmrOneD 11858 Specdb::NmrOneD 11859 Specdb::NmrOneD 11860 Specdb::NmrOneD 11861 Specdb::MsMs 324691 Specdb::MsMs 324692 Specdb::MsMs 324693 Specdb::MsMs 373165 Specdb::MsMs 373166 Specdb::MsMs 373167 Specdb::MsMs 2336812 Specdb::MsMs 2336813 Specdb::MsMs 2336814 Specdb::MsMs 2628464 Specdb::MsMs 2628465 Specdb::MsMs 2628466 HMDB13112 16287