| SpectraBase Compound ID | DMPYv0vOxny |
|---|---|
| InChI | InChI=1S/C58H96N6O8/c1-3-5-7-9-11-13-15-17-27-41-53(65)59-43-33-29-39-51(63-57(69)71-47-49-35-23-21-24-36-49)55(67)61-45-31-19-20-32-46-62-56(68)52(64-58(70)72-48-50-37-25-22-26-38-50)40-30-34-44-60-54(66)42-28-18-16-14-12-10-8-6-4-2/h21-26,35-38,51-52H,3-20,27-34,39-48H2,1-2H3,(H,59,65)(H,60,66)(H,61,67)(H,62,68)(H,63,69)(H,64,70) |
| InChIKey | WIVKIZOSTZTDFW-UHFFFAOYSA-N |
| Mol Weight | 1005.4 g/mol |
| Molecular Formula | C58H96N6O8 |
| Exact Mass | 1004.728964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8iJEXhSSsWf |
|---|---|
| Name | WIVKIZOSTZTDFW-UHFFFAOYSA-N |
| Compound Number | 8A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H96N6O8 |
| InChI | InChI=1S/C58H96N6O8/c1-3-5-7-9-11-13-15-17-27-41-53(65)59-43-33-29-39-51(63-57(69)71-47-49-35-23-21-24-36-49)55(67)61-45-31-19-20-32-46-62-56(68)52(64-58(70)72-48-50-37-25-22-26-38-50)40-30-34-44-60-54(66)42-28-18-16-14-12-10-8-6-4-2/h21-26,35-38,51-52H,3-20,27-34,39-48H2,1-2H3,(H,59,65)(H,60,66)(H,61,67)(H,62,68)(H,63,69)(H,64,70) |
| InChIKey | WIVKIZOSTZTDFW-UHFFFAOYSA-N |
| Literature Reference Author | A.COLOMER,A.PINAZO,M.A.MANRESA,M.P.VINARDELL,M.MITJANS,M.R.I NFANTE,L.PEREZ |
| Literature Reference Citation | J.MED.CHEM.,54,989(2011) |
| Literature Reference DOI | 10.1021/jm101315k |
| Molecular Weight | 1005.436 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ48018 |