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Sulfo DBCO-PEG4-TFP ester
| Catalog Number | CCR223 |
| IUPAC Name | 1-[[3-(2-Azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-1-oxo-3-[3-[2-[2-[2-[3-oxo-3-(2,3,5,6-tetrafluorophenoxy)propoxy]ethoxy]ethoxy]ethoxy]propanoylamino]propane-2-sulfonic acid |
| Molecular Weight | 851.8 |
| Molecular Formula | C39H41F4N3O12S |
| Canonical SMILES | C1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCNC(=O)C(CNC(=O)CCOCCOCCOCCOCCC(=O)OC4=C(C(=CC(=C4F)F)F)F)S(=O)(=O)O |
| InChI | InChI=1S/C39H41F4N3O12S/c40-29-23-30(41)37(43)38(36(29)42)58-35(49)13-16-55-18-20-57-22-21-56-19-17-54-15-12-33(47)45-24-32(59(51,52)53)39(50)44-14-11-34(48)46-25-28-7-2-1-5-26(28)9-10-27-6-3-4-8-31(27)46/h1-8,23,32H,11-22,24-25H2,(H,44,50)(H,45,47)(H,51,52,53) |
| InChI Key | ZUVGKZIBBJJSQX-UHFFFAOYSA-N |
| Application | SPAAC & SPANC Click Reaction |
| Complexity | 1530 |
| Exact Mass | 851.23470757 |
| Monoisotopic Mass | 851.23470757 |
| Topological Polar Surface Area | 205Ų |
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