![BENZYL-[2-(N-CHLOROFORMYL-N-METHYLAMINO)-4-NITROPHENYL-2,3,4-TRI-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-GLUCOPYRANOSID]-URONATE](/api/spectrum/D0ezk8HV7dk/structure.png?h=300&w=458 "BENZYL-[2-(N-CHLOROFORMYL-N-METHYLAMINO)-4-NITROPHENYL-2,3,4-TRI-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-GLUCOPYRANOSID]-URONATE")
| SpectraBase Compound ID | EiZXteedEe7 |
|---|---|
| InChI | InChI=1S/C39H63ClN2O10Si3/c1-37(2,3)53(11,12)50-30-31(51-54(13,14)38(4,5)6)33(52-55(15,16)39(7,8)9)35(49-32(30)34(43)47-25-26-20-18-17-19-21-26)48-29-23-22-27(42(45)46)24-28(29)41(10)36(40)44/h17-24,30-33,35H,25H2,1-16H3/t30-,31-,32-,33+,35+/m1/s1 |
| InChIKey | HTFVHDCYVWCRIT-JJTSXQPFSA-N |
| Mol Weight | 839.6 g/mol |
| Molecular Formula | C39H63ClN2O10Si3 |
| Exact Mass | 838.347904 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D0ezk8HV7dk |
|---|---|
| Name | BENZYL-[2-(N-CHLOROFORMYL-N-METHYLAMINO)-4-NITROPHENYL-2,3,4-TRI-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-GLUCOPYRANOSID]-URONATE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H63ClN2O10Si3 |
| InChI | InChI=1S/C39H63ClN2O10Si3/c1-37(2,3)53(11,12)50-30-31(51-54(13,14)38(4,5)6)33(52-55(15,16)39(7,8)9)35(49-32(30)34(43)47-25-26-20-18-17-19-21-26)48-29-23-22-27(42(45)46)24-28(29)41(10)36(40)44/h17-24,30-33,35H,25H2,1-16H3/t30-,31-,32-,33+,35+/m1/s1 |
| InChIKey | HTFVHDCYVWCRIT-JJTSXQPFSA-N |
| Literature Reference Author | F.SCHMIDT,C.MONNERET |
| Literature Reference Citation | BIOORG.MED.CHEM.,11,2277(2003) |
| Literature Reference DOI | 10.1016/S0968-0896(03)00108-1 |
| Molecular Weight | 839.646 g/mol |
| Sample ID | 29302 |
| Solvent | CDCl3 |