Physicochemical Properties
| Molecular Formula | C9H16N3O14P3 |
| Molecular Weight | 483.16 |
| Exact Mass | 482.984 |
| CAS # | 65-47-4 |
| Related CAS # | Cytidine-5'-triphosphate disodium;36051-68-0;Cytidine-5′-triphosphate-d14 disodium |
| PubChem CID | 6176 |
| Appearance | White to off-white solid powder |
| Density | 2.5±0.1 g/cm3 |
| Boiling Point | 849.2±75.0 °C at 760 mmHg |
| Melting Point | 215 - 218 °C |
| Flash Point | 467.4±37.1 °C |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.801 |
| LogP | -5.52 |
| Hydrogen Bond Donor Count | 7 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 8 |
| Heavy Atom Count | 29 |
| Complexity | 855 |
| Defined Atom Stereocenter Count | 4 |
| SMILES | C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O |
| InChi Key | PCDQPRRSZKQHHS-XVFCMESISA-N |
| InChi Code | InChI=1S/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1 |
| Chemical Name | [[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate |
| HS Tariff Code | 2934.99.9001 |
| Storage |
Powder-20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month Note: This product requires protection from light (avoid light exposure) during transportation and storage. |
| Shipping Condition | Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs) |
Biological Activity
| Targets | Human Endogenous Metabolite |
| References |
[1]. A CTP Synthase Undergoing Stage-Specific Spatial Expression Is Essential for the Survival of the Intracellular Parasite Toxoplasma gondii. Front Cell Infect Microbiol. 2018 Mar 22;8:83. |
| Additional Infomation |
CTP is a pyrimidine ribonucleoside 5'-triphosphate and a cytidine 5'-phosphate. It has a role as an Escherichia coli metabolite and a mouse metabolite. It is a conjugate acid of a CTP(4-) and a CTP(3-). Cytidine triphosphate is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). Cytidine-5'-triphosphate has been reported in Homo sapiens, Apis cerana, and Caenorhabditis elegans with data available. Cytidine Triphosphate is a cytosine derived nucleotide comprised of three phosphate groups esterified to the deoxyribose sugar moiety. Nucleotide metabolism is upregulated in cancer cells; therefore, this nucleotide could be used as a biomarker to detect the presence of cancer cells. Cytidine triphosphate is a metabolite found in or produced by Saccharomyces cerevisiae. Cytidine 5'-(tetrahydrogen triphosphate). A cytosine nucleotide containing three phosphate groups esterified to the sugar moiety. |
Solubility Data
| Solubility (In Vitro) |
H2O : 83.33 mg/mL (172.47 mM) DMSO : < 1 mg/mL |
| Solubility (In Vivo) |
Solubility in Formulation 1: 100 mg/mL (206.97 mM) in PBS (add these co-solvents sequentially from left to right, and one by one), clear solution; with sonication.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 2.0697 mL | 10.3485 mL | 20.6971 mL | |
| 5 mM | 0.4139 mL | 2.0697 mL | 4.1394 mL | |
| 10 mM | 0.2070 mL | 1.0349 mL | 2.0697 mL |