1.0 2016-10-03 18:35:44 UTC 2020-04-22 15:49:32 UTC BMDB0012302 BMDB12302 UDP-D-galacturonate UDPgalacturonate Uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphate) UDPgalacturonic acid Uridine 5'-(a-D-galactopyranosyluronate pyrophosphate) Uridine 5'-(a-D-galactopyranosyluronic acid pyrophosphoric acid) Uridine 5'-(alpha-D-galactopyranosyluronate pyrophosphate) Uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphoric acid) Uridine 5'-(α-D-galactopyranosyluronate pyrophosphate) Uridine 5'-(α-D-galactopyranosyluronic acid pyrophosphoric acid) UDP-D-Galacturonic acid UDP-D-Galacturonate UDP-a-D-Galacturonate UDP-a-D-Galacturonic acid UDP-alpha-D-Galacturonate UDP-α-D-galacturonate UDP-α-D-galacturonic acid UDP-Gal-ua Uridine diphosphogalacturonic acid UDP-galacturonic acid UDP-GalA UDPGalAc UDPGalurAc Uridine diphosphate galacturonic acid Uridine pyrophosphate galacturonic acid C15H22N2O18P2 580.2853 580.034284934 (2S,3R,4S,5R,6R)-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid udp-galacturonic acid 50722-58-2 O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O InChI=1S/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/t4-,6-,7+,8-,9-,10-,11+,12-,14-/m1/s1 HDYANYHVCAPMJV-GXNRKQDOSA-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. Organic compounds Nucleosides, nucleotides, and analogues Pyrimidine nucleotides Pyrimidine nucleotide sugars Pyrimidine nucleotide sugars Azacyclic compounds Beta hydroxy acids and derivatives Carbonyl compounds Carboxylic acids Glucuronic acid derivatives Glycosylamines Heteroaromatic compounds Hydrocarbon derivatives Hydropyrimidines Lactams Monoalkyl phosphates Monocarboxylic acids and derivatives Monosaccharide phosphates Organic oxides Organic pyrophosphates Organonitrogen compounds Organopnictogen compounds Oxacyclic compounds Oxanes Pentose phosphates Polyols Pyrans Pyrimidine ribonucleoside diphosphates Pyrimidones Secondary alcohols Tetrahydrofurans Ureas Vinylogous amides Alcohol Alkyl phosphate Aromatic heteromonocyclic compound Azacycle Beta-hydroxy acid Carbonyl group Carboxylic acid Carboxylic acid derivative Glucuronic acid or derivatives Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydropyrimidine Hydroxy acid Lactam Monoalkyl phosphate Monocarboxylic acid or derivatives Monosaccharide Monosaccharide phosphate 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 Polyol Pyran Pyrimidine Pyrimidine nucleotide sugar Pyrimidine ribonucleoside diphosphate Pyrimidone Secondary alcohol Tetrahydrofuran Urea Vinylogous amide Aromatic heteromonocyclic compounds UDP-D-galacturonic acid Solid logp -1.21 ALOGPS logs -1.51 ALOGPS logp -4.7 ChemAxon pka_strongest_acidic 1.72 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac (2S,3R,4S,5R,6R)-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid ChemAxon average_mass 580.2853 ChemAxon mono_mass 580.034284934 ChemAxon smiles O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O ChemAxon formula C15H22N2O18P2 ChemAxon inchi InChI=1S/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/t4-,6-,7+,8-,9-,10-,11+,12-,14-/m1/s1 ChemAxon inchikey HDYANYHVCAPMJV-GXNRKQDOSA-N ChemAxon polar_surface_area 308.61 ChemAxon refractivity 106.32 ChemAxon polarizability 46.96 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 15 ChemAxon donor_count 9 ChemAxon physiological_charge -3 ChemAxon formal_charge 0 ChemAxon number_of_rings 3 ChemAxon bioavailability 0 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::MsMs 322105 Specdb::MsMs 322106 Specdb::MsMs 322107 Specdb::MsMs 369937 Specdb::MsMs 369938 Specdb::MsMs 369939 Specdb::MsMs 2755552 Specdb::MsMs 2755553 Specdb::MsMs 2755554 Specdb::MsMs 2954217 Specdb::MsMs 2954218 Specdb::MsMs 2954219 Specdb::NmrOneD 97158 Specdb::NmrOneD 97159 Specdb::NmrOneD 97160 Specdb::NmrOneD 97161 Specdb::NmrOneD 97162 Specdb::NmrOneD 97163 Specdb::NmrOneD 97164 Specdb::NmrOneD 97165 Specdb::NmrOneD 97166 Specdb::NmrOneD 97167 Specdb::NmrOneD 97168 Specdb::NmrOneD 97169 Specdb::NmrOneD 97170 Specdb::NmrOneD 97171 Specdb::NmrOneD 97172 Specdb::NmrOneD 97173 Specdb::NmrOneD 97174 Specdb::NmrOneD 97175 Specdb::NmrOneD 97176 Specdb::NmrOneD 97177 Specdb::CMs 25346 Specdb::CMs 39906 Specdb::CMs 282533 Specdb::CMs 392187 Specdb::CMs 392188 Specdb::CMs 392189 Specdb::CMs 392190 Specdb::CMs 392191 Specdb::CMs 392192 Specdb::CMs 392193 Specdb::CMs 392194 Specdb::CMs 392195 Specdb::CMs 392196 Specdb::CMs 392197 Specdb::CMs 392198 Specdb::CMs 392199 Specdb::CMs 392200 Specdb::CMs 392201 Specdb::CMs 392202 Specdb::CMs 392203 Specdb::CMs 392204 Specdb::CMs 392205 Specdb::CMs 392206 Specdb::CMs 392207 Specdb::CMs 392208 FDB028925 21864803 C00617 15592253 16085 UGB UDP-D-GALACTURONATE C00007237