| SpectraBase Compound ID | 66TakEe3qTL |
|---|---|
| InChI | InChI=1S/C22H45N5O11.5C2H4O2/c1-8-12(26)18(33-4-2-28)20(34-5-3-29)22(35-8)38-19-14(30)9(24)6-10(25)17(19)37-21-13(27)16(32)15(31)11(7-23)36-21;5*1-2(3)4/h8-22,28-32H,2-7,23-27H2,1H3;5*1H3,(H,3,4)/t8-,9+,10-,11+,12-,13+,14-,15+,16+,17+,18+,19+,20-,21+,22+;;;;;/m0...../s1 |
| InChIKey | BGZDOGHQJMRLEY-KKEDXCHJSA-N |
| Mol Weight | 855.886 g/mol |
| Molecular Formula | C32H65N5O21 |
| Exact Mass | 855.417204 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9UeIMPOZHrs |
|---|---|
| Name | BGZDOGHQJMRLEY-KKEDXCHJSA-N |
| Compound Number | TC025 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H65N5O21 |
| InChI | InChI=1S/C22H45N5O11.5C2H4O2/c1-8-12(26)18(33-4-2-28)20(34-5-3-29)22(35-8)38-19-14(30)9(24)6-10(25)17(19)37-21-13(27)16(32)15(31)11(7-23)36-21;5*1-2(3)4/h8-22,28-32H,2-7,23-27H2,1H3;5*1H3,(H,3,4)/t8-,9+,10-,11+,12-,13+,14-,15+,16+,17+,18+,19+,20-,21+,22+;;;;;/m0...../s1 |
| InChIKey | BGZDOGHQJMRLEY-KKEDXCHJSA-N |
| Literature Reference Author | J.LI,J.WANG,Y.HUI,C.T.CHANG |
| Literature Reference Citation | ORG.LETTERS,5,431(2003) |
| Literature Reference DOI | 10.1021/ol027288c |
| Molecular Weight | 855.889 g/mol |
| Sample ID | 49431 |
| Solvent | D2O |