| SpectraBase Compound ID | 5jerphVsGQp |
|---|---|
| InChI | InChI=1S/C44H48N8O11S2/c1-44(2,3)63-43(61)46-22-34(54)48-28-16-18-35-51(41(28)59)31(23-64-35)38(56)49-29(19-25-11-7-5-8-12-25)37(55)45-21-33(53)47-27-15-17-36-52(40(27)58)32(24-65-36)39(57)50-30(42(60)62-4)20-26-13-9-6-10-14-26/h5-18,29-32H,19-24H2,1-4H3,(H,45,55)(H,46,61)(H,47,53)(H,48,54)(H,49,56)(H,50,57)/t29-,30+,31-,32-/m0/s1 |
| InChIKey | JYRXUKXHDBIADZ-RACKDBBVSA-N |
| Mol Weight | 929.0 g/mol |
| Molecular Formula | C44H48N8O11S2 |
| Exact Mass | 928.288397 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Me9N2iHwvd |
|---|---|
| Name | JYRXUKXHDBIADZ-RACKDBBVSA-N |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H48N8O11S2 |
| InChI | InChI=1S/C44H48N8O11S2/c1-44(2,3)63-43(61)46-22-34(54)48-28-16-18-35-51(41(28)59)31(23-64-35)38(56)49-29(19-25-11-7-5-8-12-25)37(55)45-21-33(53)47-27-15-17-36-52(40(27)58)32(24-65-36)39(57)50-30(42(60)62-4)20-26-13-9-6-10-14-26/h5-18,29-32H,19-24H2,1-4H3,(H,45,55)(H,46,61)(H,47,53)(H,48,54)(H,49,56)(H,50,57)/t29-,30+,31-,32-/m0/s1 |
| InChIKey | JYRXUKXHDBIADZ-RACKDBBVSA-N |
| Literature Reference Author | P.TREMMEL,A.GEYER |
| Literature Reference Citation | EUR.J.ORG.CHEM.,3475(2005) |
| Molecular Weight | 929.032 g/mol |
| Sample ID | 30135 |
| Solvent | DMSO-D6 |