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Disulfide biotin alkyne
| Catalog Number | CCR148 |
| IUPAC Name | 5-[(3aS,4S,6aR)-2-Oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[2-[2-[3-oxo-3-[2-[[3-oxo-3-(prop-2-ynylamino)propyl]disulfanyl]ethylamino]propoxy]ethoxy]ethoxy]ethyl]pentanamide |
| Molecular Weight | 647.87 |
| Molecular Formula | C27H45N5O7S3 |
| Canonical SMILES | C#CCNC(=O)CCSSCCNC(=O)CCOCCOCCOCCNC(=O)CCCCC1C2C(CS1)NC(=O)N2 |
| InChI | InChI=1S/C27H45N5O7S3/c1-2-9-28-25(35)8-18-41-42-19-11-30-24(34)7-12-37-14-16-39-17-15-38-13-10-29-23(33)6-4-3-5-22-26-21(20-40-22)31-27(36)32-26/h1,21-22,26H,3-20H2,(H,28,35)(H,29,33)(H,30,34)(H2,31,32,36)/t21-,22-,26-/m0/s1 |
| InChI Key | URIQRXYRNUOLIF-MCEYFSPLSA-N |
| Appearance | Solid to oil |
| Application | CuAAC & Thiol-Yne & Spontaneous Amino-Yne Click Reaction |
| Storage | -20 °C |
| Complexity | 876 |
| Exact Mass | 647.24811231 |
| Isomeric SMILES | C#CCNC(=O)CCSSCCNC(=O)CCOCCOCCOCCNC(=O)CCCC[C@H]1[C@@H]2[C@H](CS1)NC(=O)N2 |
| Monoisotopic Mass | 647.24811231 |
| Topological Polar Surface Area | 232Ų |
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