2.0 2012-08-09 09:25:18 -0600 2015-06-03 17:21:43 -0600 ECMDB21527 M2MDB001922 Deoxycytidine 5'-triphosphate Deoxycytidine triphosphate (dCTP) is a cytidine nucleotide triphosphate that is used whenever DNA is synthesized by DNA polymerase. During DNA synthesis dCTP has the PPi (pyrophosphate) cleaved off and the dCMP is incorporated into the DNA strand at the 3' end. 2'-Deoxycytidine 5'-(tetrahydrogen triphosphate) 2'-Deoxycytidine 5'-(tetrahydrogen triphosphoric acid) 2'-Deoxycytidine 5'-triphosphate 2'-Deoxycytidine 5'-triphosphoric acid 2'-Deoxycytidine-5'-triphosphate 2'-Deoxycytidine-5'-triphosphoric acid 2-Deoxycytidine 5-triphosphate 2-Deoxycytidine 5-triphosphoric acid DCTP Deoxy-CTP Deoxycytidine 5'-triphosphate Deoxycytidine 5'-triphosphoric acid Deoxycytidine 5-triphosphate Deoxycytidine 5-triphosphoric acid Deoxycytidine triphosphate Deoxycytidine triphosphoric acid Deoxycytidine-triphosphate Deoxycytidine-triphosphoric acid C9H16N3O13P3 467.1569 466.989597149 ({[({[(2S,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid ({[(2S,3R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxyphosphonic acid 2056-98-6 NC1=NC(=O)N(C=C1)[C@H]1C[C@@H](O)[C@H](CO[P@@](O)(=O)O[P@](O)(=O)OP(O)(O)=O)O1 InChI=1S/C9H16N3O13P3/c10-7-1-2-12(9(14)11-7)8-3-5(13)6(23-8)4-22-27(18,19)25-28(20,21)24-26(15,16)17/h1-2,5-6,8,13H,3-4H2,(H,18,19)(H,20,21)(H2,10,11,14)(H2,15,16,17)/t5-,6+,8-/m1/s1 RGWHQCVHVJXOKC-GKROBHDKSA-N Solid Cytoplasm logp -0.52 ALOGPS logs -1.60 ALOGPS solubility 1.18e+01 g/l ALOGPS logp -3.6 ChemAxon pka_strongest_acidic 0.95 ChemAxon pka_strongest_basic -0.05 ChemAxon iupac ({[({[(2S,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid ChemAxon average_mass 467.1569 ChemAxon mono_mass 466.989597149 ChemAxon smiles NC1=NC(=O)N(C=C1)[C@H]1C[C@@H](O)[C@H](CO[P@@](O)(=O)O[P@](O)(=O)OP(O)(O)=O)O1 ChemAxon formula C9H16N3O13P3 ChemAxon inchi InChI=1S/C9H16N3O13P3/c10-7-1-2-12(9(14)11-7)8-3-5(13)6(23-8)4-22-27(18,19)25-28(20,21)24-26(15,16)17/h1-2,5-6,8,13H,3-4H2,(H,18,19)(H,20,21)(H2,10,11,14)(H2,15,16,17)/t5-,6+,8-/m1/s1 ChemAxon inchikey RGWHQCVHVJXOKC-GKROBHDKSA-N ChemAxon polar_surface_area 247.97 ChemAxon refractivity 85.65 ChemAxon polarizability 35.29 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 12 ChemAxon donor_count 6 ChemAxon physiological_charge -3 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 1083295 Specdb::EiMs 2444 Specdb::NmrOneD 343028 Specdb::NmrOneD 343029 Specdb::NmrOneD 343030 Specdb::NmrOneD 343031 Specdb::NmrOneD 343032 Specdb::NmrOneD 343033 Specdb::NmrOneD 343034 Specdb::NmrOneD 343035 Specdb::NmrOneD 343036 Specdb::NmrOneD 343037 Specdb::NmrOneD 343038 Specdb::NmrOneD 343039 Specdb::NmrOneD 343040 Specdb::NmrOneD 343041 Specdb::NmrOneD 343042 Specdb::NmrOneD 343043 Specdb::NmrOneD 343044 Specdb::NmrOneD 343045 Specdb::NmrOneD 343046 Specdb::NmrOneD 343047 Specdb::MsMs 27644 Specdb::MsMs 27645 Specdb::MsMs 27646 Specdb::MsMs 34202 Specdb::MsMs 34203 Specdb::MsMs 34204 HMDB00998 625 C00458 16311 dCTP Winder, C. L., Dunn, W. B., Schuler, S., Broadhurst, D., Jarvis, R., Stephens, G. M., Goodacre, R. (2008). "Global metabolic profiling of Escherichia coli cultures: an evaluation of methods for quenching and extraction of intracellular metabolites." Anal Chem 80:2939-2948. 18331064 DNA polymerase I P00582 DPO1_ECOLI polA http://ecmdb.ca/proteins/P00582.xml