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C12FDGlcU
| Catelog Number | A18-0087 |
| Category | Fluorescent Enzyme Substrates |
| Molecular Formula | C44H51NO18 |
| Molecular Weight | 881.87 |
| Catalog Number | Size | Price | Quantity |
|---|---|---|---|
| A18-0087 | -- | $-- |
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Product Introduction
C12FDGlcU is a fluorogenic substrate for beta-glucuronidase.
Chemical Information |
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|---|---|
| IUPAC Name | (2S,3S,4S,5R,6S)-6-[6'-[(2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-5-(dodecanoylamino)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid |
| Canonical SMILES | CCCCCCCCCCCC(=O)NC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)OC5C(C(C(C(O5)C(=O)O)O)O)O)OC6=C3C=CC(=C6)OC7C(C(C(C(O7)C(=O)O)O)O)O)OC2=O |
| InChI | InChI=1S/C44H51NO18/c1-2-3-4-5-6-7-8-9-10-11-30(46)45-21-12-15-25-24(18-21)41(57)63-44(25)26-16-13-22(58-42-35(51)31(47)33(49)37(61-42)39(53)54)19-28(26)60-29-20-23(14-17-27(29)44)59-43-36(52)32(48)34(50)38(62-43)40(55)56/h12-20,31-38,42-43,47-52H,2-11H2,1H3,(H,45,46)(H,53,54)(H,55,56)/t31-,32-,33-,34-,35+,36+,37-,38-,42+,43+/m0/s1 |
| InChI Key | BCUYISQZSHBHEJ-ASDHSWNRSA-N |
| Appearance | Solid Powder |
Computed Properties | |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 18 |
| Rotatable Bond Count | 17 |
| Exact Mass | 881.31061378 g/mol |
| Monoisotopic Mass | 881.31061378 g/mol |
| Topological Polar Surface Area | 298Ų |
| Heavy Atom Count | 63 |
| Formal Charge | 0 |
| Complexity | 1510 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 10 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| US-5208148-A | Lipophilic fluorescent glycosidase substrates | 1990-12-07 |
Applications of Fluorescent Probes & Dyes
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