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TAMRA-PEG3-biotin | 2279944-59-9
| Catelog Number | F07-0029 |
| Category | TAMRA |
| Molecular Formula | C₄₃H₅₄N₆O₉S |
| Molecular Weight | 830.99 |
| Catalog Number | Size | Price | Quantity |
|---|---|---|---|
| F07-0029 | -- | $-- |
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Product Introduction
TAMRA-PEG3-biotin is a polyethylene glycol (PEG)-based PROTAC linker. TAMRA-PEG3-biotin can be used in the synthesis of a series of PROTACs.
Chemical Information |
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|---|---|
| Synonyms | TAMRA-PEG3-DL-biotin; N-(2-{2-[2-(2-{[3',6'-bis(dimethylamino)-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-5-yl]formamido}ethoxy)ethoxy]ethoxy}ethyl)-5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanamide |
| Purity | 831.0 |
| IUPAC Name | 3',6'-bis(dimethylamino)-3-oxo-N-[2-[2-[2-[2-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]ethoxy]ethoxy]ethoxy]ethyl]spiro[2-benzofuran-1,9'-xanthene]-5-carboxamide |
| Canonical SMILES | CN(C)C1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)C(=O)NCCOCCOCCOCCNC(=O)CCCCC5C6C(CS5)NC(=O)N6)C(=O)O3)C7=C(O2)C=C(C=C7)N(C)C |
| InChI | InChI=1S/C43H54N6O9S/c1-48(2)28-10-13-32-35(24-28)57-36-25-29(49(3)4)11-14-33(36)43(32)31-12-9-27(23-30(31)41(52)58-43)40(51)45-16-18-55-20-22-56-21-19-54-17-15-44-38(50)8-6-5-7-37-39-34(26-59-37)46-42(53)47-39/h9-14,23-25,34,37,39H,5-8,15-22,26H2,1-4H3,(H,44,50)(H,45,51)(H2,46,47,53) |
| InChI Key | BWYKRFATNNMLLL-UHFFFAOYSA-N |
Product Specification |
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|---|---|
| Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
Computed Properties | |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 20 |
| Exact Mass | 830.36729849 g/mol |
| Monoisotopic Mass | 830.36729849 g/mol |
| Topological Polar Surface Area | 194Ų |
| Heavy Atom Count | 59 |
| Formal Charge | 0 |
| Complexity | 1410 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
Applications of Fluorescent Probes & Dyes
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