1.0 2016-10-03 18:22:11 UTC 2020-05-11 20:42:33 UTC BMDB0011641 BMDB11641 Uridine 2'-phosphate Uridine 2'-monophosphate Uridine 2'-monophosphoric acid Uridine 2'-phosphoric acid 2'-Phosphouridine 2'-UMP 2'-Uridylate 2'-Uridylic acid Uridine 2'-(dihydrogen phosphate) C9H13N2O9P 324.1813 324.035866536 {[(2R,3R,4R,5R)-2-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid uridine 2'-phosphate 131-83-9 OC[C@H]1O[C@H]([C@H](OP(O)(O)=O)[C@@H]1O)N1C=CC(=O)NC1=O InChI=1S/C9H13N2O9P/c12-3-4-6(14)7(20-21(16,17)18)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14H,3H2,(H,10,13,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1 HQIDPEYTETUCNF-XVFCMESISA-N belongs to the class of organic compounds known as pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups. Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Pentose phosphates Azacyclic compounds Glycosylamines Heteroaromatic compounds Hydrocarbon derivatives Hydropyrimidines Hydroxypyrimidines Monoalkyl phosphates Organic oxides Organonitrogen compounds Organopnictogen compounds Oxacyclic compounds Primary alcohols Pyrimidones Secondary alcohols Tetrahydrofurans Alcohol Alkyl phosphate Aromatic heteromonocyclic compound Azacycle Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydropyrimidine Hydroxypyrimidine Monoalkyl phosphate N-glycosyl compound Organic nitrogen compound Organic oxide Organic phosphoric acid derivative Organoheterocyclic compound Organonitrogen compound Organopnictogen compound Oxacycle Pentose phosphate Phosphoric acid ester Primary alcohol Pyrimidine Pyrimidone Secondary alcohol Tetrahydrofuran Aromatic heteromonocyclic compounds pyrimidine ribonucleoside 2'-monophosphate uridine phosphate Solid logp -1.72 ALOGPS logs -1.42 ALOGPS logp -2.5 ChemAxon pka_strongest_acidic 0.72 ChemAxon pka_strongest_basic -3 ChemAxon iupac {[(2R,3R,4R,5R)-2-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid ChemAxon average_mass 324.1813 ChemAxon mono_mass 324.035866536 ChemAxon smiles OC[C@H]1O[C@H]([C@H](OP(O)(O)=O)[C@@H]1O)N1C=CC(=O)NC1=O ChemAxon formula C9H13N2O9P ChemAxon inchi InChI=1S/C9H13N2O9P/c12-3-4-6(14)7(20-21(16,17)18)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14H,3H2,(H,10,13,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1 ChemAxon inchikey HQIDPEYTETUCNF-XVFCMESISA-N ChemAxon polar_surface_area 165.86 ChemAxon refractivity 63.44 ChemAxon polarizability 26.45 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 8 ChemAxon donor_count 5 ChemAxon physiological_charge -2 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::NmrOneD 93772 Specdb::NmrOneD 93773 Specdb::NmrOneD 93774 Specdb::NmrOneD 93775 Specdb::NmrOneD 93776 Specdb::NmrOneD 93777 Specdb::NmrOneD 93778 Specdb::NmrOneD 93779 Specdb::NmrOneD 93780 Specdb::NmrOneD 93781 Specdb::NmrOneD 93782 Specdb::NmrOneD 93783 Specdb::NmrOneD 93784 Specdb::NmrOneD 93785 Specdb::NmrOneD 93786 Specdb::NmrOneD 93787 Specdb::NmrOneD 93788 Specdb::NmrOneD 93789 Specdb::NmrOneD 93790 Specdb::NmrOneD 93791 Specdb::MsMs 321388 Specdb::MsMs 321389 Specdb::MsMs 321390 Specdb::MsMs 369013 Specdb::MsMs 369014 Specdb::MsMs 369015 Specdb::MsMs 2322064 Specdb::MsMs 2322065 Specdb::MsMs 2322066 Specdb::MsMs 2613886 Specdb::MsMs 2613887 Specdb::MsMs 2613888 Specdb::CMs 24994 Specdb::CMs 39737 Specdb::CMs 156201 Placenta Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 FDB028338 C03031 91808 101609 28070