| SpectraBase Compound ID | L1tDHgLpoRj |
|---|---|
| InChI | InChI=1S/C54H62N2O12/c1-53(2,37-63-33-39-23-27-41(59-5)28-24-39)47-21-17-13-9-11-15-19-44(62-8)32-50-56-46(36-66-50)52(58)68-48(54(3,4)38-64-34-40-25-29-42(60-6)30-26-40)22-18-14-10-12-16-20-43(61-7)31-49-55-45(35-65-49)51(57)67-47/h13-20,23-30,35-36,43-44,47-48H,21-22,31-34,37-38H2,1-8H3/b17-13-,18-14-,19-15+,20-16+/t43-,44-,47-,48-/m0/s1 |
| InChIKey | NDZNEJYJYWBPQD-LFCGPBMPSA-N |
| Mol Weight | 931.1 g/mol |
| Molecular Formula | C54H62N2O12 |
| Exact Mass | 930.430275 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8gBVr5kB8yJ |
|---|---|
| Name | NDZNEJYJYWBPQD-LFCGPBMPSA-N |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H62N2O12 |
| InChI | InChI=1S/C54H62N2O12/c1-53(2,37-63-33-39-23-27-41(59-5)28-24-39)47-21-17-13-9-11-15-19-44(62-8)32-50-56-46(36-66-50)52(58)68-48(54(3,4)38-64-34-40-25-29-42(60-6)30-26-40)22-18-14-10-12-16-20-43(61-7)31-49-55-45(35-65-49)51(57)67-47/h13-20,23-30,35-36,43-44,47-48H,21-22,31-34,37-38H2,1-8H3/b17-13-,18-14-,19-15+,20-16+/t43-,44-,47-,48-/m0/s1 |
| InChIKey | NDZNEJYJYWBPQD-LFCGPBMPSA-N |
| Literature Reference Author | B.NIESS,I.V.HARTUNG,L.O.HAUSTEDT,H.M.R.HOFFMANN |
| Literature Reference Citation | EUR.J.ORG.CHEM.,1132(2006) |
| Molecular Weight | 931.092 g/mol |
| Sample ID | 31959 |
| Solvent | CDCl3 |