1. Primary Information
| English name: | Cytidine-5'-triphosphate disodium salt |
| CAS No.: | 36051-68-0 |
| Molecular formula: | C9H14N3NA2O14P3 |
| Molecular weight: | 527.12 g/mol |
| SMILES: | C1=CN(C(=O)N=C1N)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OP(=O)(O)[O-])O)O.[Na+].[Na+] |
| Structural class: | |
| Other identifiers: |
- |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 20mg | HPLC≥98% | 120 | -20℃ | in stock | - |
| Kehua Intelligence | 100mg | 高纯，95% | 32 | -20℃ | in stock | - |
| Kehua Intelligence | 500mg | 高纯，95% | 56 | -20℃ | in stock | - |
| Kehua Intelligence | 1g | 高纯，95% | 76 | -20℃ | in stock | - |
| Kehua Intelligence | 5g | 高纯，95% | 280 | -20℃ | in stock | - |
| Kehua Intelligence | 25g | 高纯，95% | 960 | -20℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
disodium;[[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate
4.2 InChI
InChI=1S/C9H16N3O14P3.2Na/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);;/q;2*+1/p-2/t4-,6-,7-,8-;;/m1../s1
4.3 InChIKey
NFQMDTRPCFJJND-WFIJOQBCSA-L
4.4 Canonical SMILES
C1=CN(C(=O)N=C1N)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OP(=O)(O)[O-])O)O.[Na+].[Na+]
4.5 Isomeric 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.[Na+].[Na+]
