Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB02976"

Predicate	Value (sorted: default)
rdfs:label	"Uridine-5'-Monophosphate 2-Deoxy-2-Fluoro-Galactopyranosyl-Monophosphate Ester"
rdf:type	drugbank:drugs
drugbank:description	" experimental This compound belongs to the pyrimidine nucleotide sugars. These are pyrimidine nucleotides bound to a saccharide derivative through the terminal phosphate group. Pyrimidine Nucleotide Sugars Organic Compounds Organooxygen Compounds Carbohydrates and Carbohydrate Conjugates Glycosyl Compounds Pyrimidine Ribonucleoside Diphosphates Mixed Pentose/Hexose Disaccharides Disaccharide Phosphates Organic Pyrophosphates Pyrimidones Organic Phosphoric Acids Hydropyrimidines Oxanes Organophosphate Esters Oxolanes Tetrahydrofurans Secondary Alcohols Fluorohydrins 1,2-Diols Polyamines Ethers Primary Alcohols Alkyl Fluorides Organofluorides mixed pentose/hexose disaccharide disaccharide phosphate disaccharide organic pyrophosphate pyrimidone hydropyrimidine organic phosphate oxane phosphoric acid ester pyrimidine oxolane tetrahydrofuran secondary alcohol halohydrin 1,2-diol fluorohydrin polyamine ether primary alcohol alcohol organohalogen amine organofluoride organonitrogen compound alkyl halide alkyl fluoride logP -0.94 ALOGPS logS -1.4 ALOGPS Water Solubility 2.17e+01 g/l ALOGPS logP -4.1 ChemAxon IUPAC Name [({[(2S,3R,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]({[(2S,3R,4S,5S,6R)-3-fluoro-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})phosphinic acid ChemAxon Traditional IUPAC Name {[(2S,3R,4R,5R)-5-(2,4-dioxo-3H-pyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy[(2S,3R,4S,5S,6R)-3-fluoro-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphosphinic acid ChemAxon Molecular Weight 568.2928 ChemAxon Monoisotopic Weight 568.050683927 ChemAxon SMILES OC[C@H]1O[C@@H](O[P@](O)(=O)O[P@@](O)(=O)OC[C@@H]2O[C@H]([C@H](O)[C@H]2O)N2C=CC(=O)NC2=O)[C@H](F)[C@@H](O)[C@@H]1O ChemAxon Molecular Formula C15H23FN2O16P2 ChemAxon InChI InChI=1S/C15H23FN2O16P2/c16-8-11(23)9(21)5(3-19)32-14(8)33-36(28,29)34-35(26,27)30-4-6-10(22)12(24)13(31-6)18-2-1-7(20)17-15(18)25/h1-2,5-6,8-14,19,21-24H,3-4H2,(H,26,27)(H,28,29)(H,17,20,25)/t5-,6+,8-,9-,10+,11-,12-,13-,14+/m1/s1 ChemAxon InChIKey InChIKey=NGTCPFGWXMBZEP-IRCXUGDUSA-N ChemAxon Polar Surface Area (PSA) 271.31 ChemAxon Refractivity 104.76 ChemAxon Polarizability 45.75 ChemAxon Rotatable Bond Count 9 ChemAxon H Bond Acceptor Count 13 ChemAxon H Bond Donor Count 8 ChemAxon pKa (strongest acidic) 1.73 ChemAxon pKa (strongest basic) -3 ChemAxon Physiological Charge -2 ChemAxon Number of Rings 3 ChemAxon Bioavailability 0 ChemAxon MDDR-Like Rule true ChemAxon PubChem Compound 46936545 PubChem Substance 46509153 PDB UPF BE0002699 Glycosyl transferase Neisseria meningitidis unknown Glycosyl transferase Involved in transferase activity, transferring hexosyl groups lgtC None 7.8 35744.0 Neisseria meningitidis GenBank Gene Database U65788 UniProtKB P96945 UniProt Accession P96945_NEIME >Glycosyl transferase MDIVFAADDNYAAYLCVAAKSVEAAHPDTEIRFHVLDAGISEANRAAVAANLRGGGGNIR FIDVNPEDFAGFPLNIRHISITTYARLKLGEYIADCDKVLYLDIDVLVRDSLTPLWDTDL GDNWLGACIDLFVERQEGYKQKIGMADGEYYFNAGVLLINLKKWRRHDIFKMSCEWVEQY KDVMQYQDQDILNGLFKGGVCYANSRFNFMPTNYAFMANWFASRHTDPLYRDRTNTVMPV AVSHYCGSAKPWHRDCTAWGAERFTELGGSLTTVPEEWRGKLAVPHRMFSTKRMLQRWRR KLSARFLRKIY >936 bp ATGGACATCGTATTTGCGGCAGACGACAACTATGCCGCCTATCTTTGCGTTGCGGCAAAA AGCGTGGAAGCGGCCCATCCCGATACGGAAATCAGGTTCCACGTCCTCGATGCCGGCATC AGTGAGGCAAACCGGGCGGCGGTTGCCGCCAATTTGCGGGGGGGGGGGGGTAATATCCGC TTTATAGACGTAAACCCCGAAGATTTCGCCGGCTTCCCCTTAAACATCAGGCACATTTCC ATTACGACTTATGCCCGCCTGAAATTGGGCGAATACATTGCCGATTGCGATAAAGTCCTG TATCTGGATATAGACGTATTGGTCAGGGACAGCCTGACGCCCTTATGGGATACCGATTTG GGCGATAACTGGCTTGGCGCGTGCATTGATTTATTTGTCGAAAGGCAGGAAGGCTACAAA CAAAAAATCGGTATGGCGGACGGCGAATATTATTTCAATGCCGGCGTATTGCTGATCAAC CTGAAAAAGTGGCGGCGGCACGATATTTTCAAAATGTCCTGCGAATGGGTGGAACAATAC AAGGACGTGATGCAATATCAGGATCAGGACATTTTGAACGGGCTGTTTAAAGGCGGGGTG TGTTATGCGAACAGCCGTTTCAACTTTATGCCGACCAATTATGCCTTTATGGCGAACTGG TTTGCGTCCCGCCATACCGACCCGCTTTACCGCGACCGTACCAATACGGTGATGCCCGTC GCCGTCAGCCATTATTGCGGCTCGGCAAAGCCGTGGCACAGGGACTGCACCGCGTGGGGT GCGGAACGTTTCACAGAGTTGGGCGGCAGCCTGACGACCGTTCCCGAAGAATGGCGCGGC AAACTTGCCGTCCCGCACCGTATGTTTTCGACAAAGCGTATGCTTCAAAGATGGCGCAGA AAGCTGTCTGCCAGATTCTTACGCAAGATTTATTGA PF01501 Glyco_transf_8 function transferase activity, transferring hexosyl groups function catalytic activity function transferase activity function transferase activity, transferring glycosyl groups process macromolecule biosynthesis process carbohydrate biosynthesis process physiological process process metabolism process macromolecule metabolism BE0002871 LgtC Neisseria meningitidis unknown LgtC Involved in transferase activity, transferring hexosyl groups lgtC None 8.05 35738.0 Neisseria meningitidis GenBank Gene Database AF355193 UniProtKB Q93EK7 UniProt Accession Q93EK7_NEIME >LgtC MDIVFAADDNYAAYLCVAAKSVEAAHPDTEIRFHVLDAGISEANRAAVAANLRGGGGNIR FIDVNPEDFAGFPLNIRHISITTYARLKLGEYIADCDKVLYLDIDVLVRDSLTPLWDTDL GDNWLGACIDLFVERQEGYKQKIGMADGEYYFNAGVLLINLKKWRRHDIFKMSCEWVEQY KDVMQYQDQDILNGLFKGGVCYANSRFNFMPTNYAFMANRFASRHTDPLYRDRTNTVMPV AVSHYCGPAKPWHRDCTAWGAERFTELAGSLTTVPEEWRGKLAVPHRMFSTKRMLQRWRR KLSARFLRKIY >936 bp ATGGACATCGTATTTGCGGCAGACGACAACTATGCCGCCTATCTTTGCGTTGCGGCAAAA AGCGTGGAAGCGGCCCATCCCGATACGGAAATCAGGTTCCACGTCCTCGATGCCGGCATC AGTGAGGCAAACCGGGCGGCGGTTGCCGCCAATTTGCGGGGGGGGGGGGGTAATATCCGC TTTATAGACGTAAACCCCGAAGATTTCGCCGGCTTCCCCTTAAACATCAGGCACATTTCC ATTACGACTTATGCCCGCCTGAAATTGGGCGAATACATTGCCGATTGCGATAAAGTCCTG TATCTGGATATAGACGTATTGGTCAGGGACAGCCTGACGCCCTTATGGGATACCGATTTG GGCGATAACTGGCTTGGCGCGTGCATTGATTTGTTTGTCGAAAGGCAGGAAGGCTACAAA CAAAAAATCGGTATGGCGGACGGCGAATATTATTTCAATGCCGGCGTATTGCTGATCAAC CTGAAAAAGTGGCGGCGGCACGATATTTTCAAAATGTCCTGCGAATGGGTGGAACAATAC AAGGACGTGATGCAATATCAGGATCAGGACATTTTGAACGGGCTGTTTAAAGGCGGGGTG TGTTATGCGAACAGCCGTTTCAACTTTATGCCGACCAATTATGCCTTTATGGCGAACAGG TTTGCGTCCCGCCATACCGACCCGCTTTACCGCGACCGTACCAATACGGTGATGCCCGTC GCCGTCAGCCATTATTGCGGCCCGGCAAAGCCGTGGCACAGGGACTGCACCGCGTGGGGT GCGGAACGTTTCACAGAGTTGGCGGGCAGCCTGACGACCGTTCCCGAAGAATGGCGCGGC AAACTTGCCGTCCCGCACCGTATGTTTTCGACAAAGCGTATGCTTCAAAGATGGCGCAGA AAGCTGTCTGCCAGATTCTTACGCAAGATTTATTGA PF01501 Glyco_transf_8 function transferase activity function transferase activity, transferring glycosyl groups function transferase activity, transferring hexosyl groups function catalytic activity process metabolism process macromolecule metabolism process macromolecule biosynthesis process carbohydrate biosynthesis process physiological process "
owl:sameAs	drug:EXPT03197

All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines3/drugbank_small.nt

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