| SpectraBase Compound ID | 9tmSaz0TdgS |
|---|---|
| InChI | InChI=1S/C53H94N2O11SSi4/c1-38(31-42-33-43(55-50(59)62-26-29-68(12,13)14)35-44(34-42)64-51(60)63-27-30-69(15,16)17)23-22-24-46(61-11)45(57)36-47(65-70(18,19)52(5,6)7)39(2)32-40(3)48(66-71(20,21)53(8,9)10)37-49(58)67-28-25-54-41(4)56/h22-24,32-35,39,46-48H,25-31,36-37H2,1-21H3,(H,54,56)(H,55,59)/b24-22+,38-23+,40-32+/t39-,46-,47+,48-/m1/s1 |
| InChIKey | YURANEOZGRYVEI-WHVGOLQWSA-N |
| Mol Weight | 1079.7 g/mol |
| Molecular Formula | C53H94N2O11SSi4 |
| Exact Mass | 1078.565539 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 98TQ0zv8G9n |
|---|---|
| Name | YURANEOZGRYVEI-WHVGOLQWSA-N |
| Compound Number | XVIII |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H94N2O11SSi4 |
| InChI | InChI=1S/C53H94N2O11SSi4/c1-38(31-42-33-43(55-50(59)62-26-29-68(12,13)14)35-44(34-42)64-51(60)63-27-30-69(15,16)17)23-22-24-46(61-11)45(57)36-47(65-70(18,19)52(5,6)7)39(2)32-40(3)48(66-71(20,21)53(8,9)10)37-49(58)67-28-25-54-41(4)56/h22-24,32-35,39,46-48H,25-31,36-37H2,1-21H3,(H,54,56)(H,55,59)/b24-22+,38-23+,40-32+/t39-,46-,47+,48-/m1/s1 |
| InChIKey | YURANEOZGRYVEI-WHVGOLQWSA-N |
| Literature Reference Author | T.FRENZEL,M.BRUNJES,M.QUITSCHALLE,A.KIRSCHNING |
| Literature Reference Citation | ORG.LETTERS,8,135(2006) |
| Literature Reference DOI | 10.1021/ol052588q |
| Molecular Weight | 1079.738 g/mol |
| Sample ID | 53325 |
| Solvent | CDCl3 |