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DBCO-PEG3-Biotin
| Catelog Number | R01-0291 |
| Category | Cycloalkyne Dyes (DBCO) |
| Molecular Formula | C37H47N5O7S |
| Molecular Weight | 705.32 |
| Catalog Number | Size | Price | Quantity |
|---|---|---|---|
| R01-0291 | -- | $-- |
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Product Introduction
A biotinylation reagent containing a DBCO moiety for click chemistry
Chemical Information |
|
|---|---|
| Purity | >95% |
| IUPAC Name | 1-[5-methoxy-2-nitro-4-[4-oxo-4-[2-[2-[2-[2-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]ethoxy]ethoxy]ethoxy]ethylamino]butoxy]phenyl]ethyl N-[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]carbamate |
| Canonical SMILES | CC(C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)NCCOCCOCCOCCNC(=O)CCCCC2C3C(CS2)NC(=O)N3)OC)OC(=O)NCCC(=O)N4CC5=CC=CC=C5C#CC6=CC=CC=C64 |
| InChI | InChI=1S/C50H63N7O13S/c1-34(70-50(62)53-20-19-47(60)56-32-37-12-4-3-10-35(37)17-18-36-11-5-6-13-40(36)56)38-30-42(65-2)43(31-41(38)57(63)64)69-23-9-16-46(59)52-22-25-67-27-29-68-28-26-66-24-21-51-45(58)15-8-7-14-44-48-39(33-71-44)54-49(61)55-48/h3-6,10-13,30-31,34,39,44,48H,7-9,14-16,19-29,32-33H2,1-2H3,(H,51,58)(H,52,59)(H,53,62)(H2,54,55,61) |
| InChI Key | QHTIWGZNJOYQBJ-UHFFFAOYSA-N |
| Solubility | DCM, THF, acetonitrile, DMF and DMSO |
| Appearance | Light yellow oil |
Product Specification |
|
|---|---|
| Storage | -20 °C |
Computed Properties | |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 29 |
| Exact Mass | 1001.42045626 g/mol |
| Monoisotopic Mass | 1001.42045626 g/mol |
| Topological Polar Surface Area | 275Ų |
| Heavy Atom Count | 71 |
| Formal Charge | 0 |
| Complexity | 1800 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 4 |
| 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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