1. Primary Information
| English name: | Talabostat mesylate |
| CAS No.: | 150080-09-4 |
| Molecular formula: | C10H23BN2O6S |
| Molecular weight: | 310.18 g/mol |
| SMILES: | B(C1CCCN1C(=O)C(C(C)C)N)(O)O.CS(=O)(=O)O |
| Structural class: | |
| Other identifiers: |
L-valinyl-L-boroproline PT 100 PT-100 PT100 cpd talabostat |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 5mg | 98% | 608 | 2-8℃ | in stock | - |
| Kehua Intelligence | 10mg | 98% | 896 | 2-8℃ | in stock | - |
| Kehua Intelligence | 50mg | 98% | 3712 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
[(2R)-1-[(2S)-2-amino-3-methylbutanoyl]pyrrolidin-2-yl]boronic acid;methanesulfonic acid
4.2 InChI
InChI=1S/C9H19BN2O3.CH4O3S/c1-6(2)8(11)9(13)12-5-3-4-7(12)10(14)15;1-5(2,3)4/h6-8,14-15H,3-5,11H2,1-2H3;1H3,(H,2,3,4)/t7-,8-;/m0./s1
4.3 InChIKey
OXYYOEIGQRXGPI-WSZWBAFRSA-N
4.4 Canonical SMILES
B(C1CCCN1C(=O)C(C(C)C)N)(O)O.CS(=O)(=O)O
4.5 Isomeric SMILES
B([C@@H]1CCCN1C(=O)[C@H](C(C)C)N)(O)O.CS(=O)(=O)O
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 --
