1. Primary Information
| English name: | Cephapirin Sodium |
| CAS No.: | 24356-60-3 |
| Molecular formula: | C17H16N3NAO6S2 |
| Molecular weight: | 445.4 g/mol |
| SMILES: | CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CSC3=CC=NC=C3)SC1)C(=O)[O-].[Na+] |
| Structural class: | |
| Other identifiers: |
BL P 1322 BL-P 1322 BLP 1322 Brisfirina Céfaloject |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 100mg | ≥95% | 76 | 2-8℃ | in stock | - |
| Kehua Intelligence | 250mg | ≥95% | 153 | 2-8℃ | in stock | - |
| Kehua Intelligence | 1g | ≥95% | 345 | 2-8℃ | in stock | - |
| Kehua Intelligence | 5g | ≥95% | 960 | 2-8℃ | in stock | - |
| Kehua Intelligence | 25g | ≥95% | 2560 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
sodium;(6R,7R)-3-(acetyloxymethyl)-8-oxo-7-[(2-pyridin-4-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
4.2 InChI
InChI=1S/C17H17N3O6S2.Na/c1-9(21)26-6-10-7-28-16-13(15(23)20(16)14(10)17(24)25)19-12(22)8-27-11-2-4-18-5-3-11;/h2-5,13,16H,6-8H2,1H3,(H,19,22)(H,24,25);/q;+1/p-1/t13-,16-;/m1./s1
4.3 InChIKey
VGEOUKPOQQEQSX-OALZAMAHSA-M
4.4 Canonical SMILES
CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CSC3=CC=NC=C3)SC1)C(=O)[O-].[Na+]
4.5 Isomeric SMILES
CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CSC3=CC=NC=C3)SC1)C(=O)[O-].[Na+]
4.6 SDF file
Coming soon
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
5.2 1H nuclear magnetic resonance (1H NMR)
5.3 Mass spectrometry (MS)
Coming soon
5.4 Infrared spectroscopy (IR)
Coming soon
5.5 Ultraviolet/visible spectroscopy (UV/Vis)
Coming soon
-- No 3D model data available --
