1. Primary Information
| English name: | Tenofovir Alafenamide Fumarate |
| CAS No.: | 1392275-56-7 |
| Molecular formula: | C46H62N12O14P2 |
| Molecular weight: | 1069.0 g/mol |
| SMILES: | CC(C)OC(=O)C(C)NP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)OC3=CC=CC=C3.CC(C)OC(=O)C(C)NP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)OC3=CC=CC=C3.C(=CC(=O)O)C(=O)O |
| Structural class: | |
| Other identifiers: |
GS-7340 GS-734003 L-alanine, N-((S)-(((1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy)methyl)phenoxyphosphinyl)-, 1-methylethyl ester tenofovir alafenamide vemlidy |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 250mg | 95% | 128 | -20℃ | in stock | - |
| Kehua Intelligence | 1g | 95% | 320 | -20℃ | in stock | - |
| Kehua Intelligence | 5g | 95% | 1280 | -20℃ | in stock | - |
| Kehua Intelligence | 5mg | 98%(HPLC) | 326 | -20℃ | in stock | - |
| Kehua Intelligence | 10mg | 98%(HPLC) | 486 | -20℃ | in stock | - |
| Kehua Intelligence | 50mg | 98%(HPLC) | 1536 | -20℃ | in stock | - |
| Kehua Intelligence | 100mg | 98%(HPLC) | 2304 | -20℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
(E)-but-2-enedioic acid;propan-2-yl (2S)-2-[[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-phenoxyphosphoryl]amino]propanoate
4.2 InChI
InChI=1S/2C21H29N6O5P.C4H4O4/c2*1-14(2)31-21(28)16(4)26-33(29,32-17-8-6-5-7-9-17)13-30-15(3)10-27-12-25-18-19(22)23-11-24-20(18)27;5-3(6)1-2-4(7)8/h2*5-9,11-12,14-16H,10,13H2,1-4H3,(H,26,29)(H2,22,23,24);1-2H,(H,5,6)(H,7,8)/b;;2-1+/t2*15-,16+,33+;/m11./s1
4.3 InChIKey
SVUJNSGGPUCLQZ-FQQAACOVSA-N
4.4 Canonical SMILES
CC(C)OC(=O)C(C)NP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)OC3=CC=CC=C3.CC(C)OC(=O)C(C)NP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)OC3=CC=CC=C3.C(=CC(=O)O)C(=O)O
4.5 Isomeric SMILES
C[C@H](CN1C=NC2=C(N=CN=C21)N)OC[P@@](=O)(N[C@@H](C)C(=O)OC(C)C)OC3=CC=CC=C3.C[C@H](CN1C=NC2=C(N=CN=C21)N)OC[P@@](=O)(N[C@@H](C)C(=O)OC(C)C)OC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O
