| SpectraBase Compound ID | ADWnSTpagbD |
|---|---|
| InChI | InChI=1S/C37H52N2O10/c1-21(2)27-11-9-23(5)28-16-31(47-32(42)12-10-26-17-39(8)20-38-26)36(7)13-14-37(49-36,48-22(3)4)25(15-29(27)28)18-44-35-34(46-24(6)40)33(43)30(41)19-45-35/h9-10,12-15,17,20-22,27-31,33-35,41,43H,11,16,18-19H2,1-8H3/b12-10+,25-15-/t27-,28+,29-,30-,31+,33-,34+,35-,36+,37-/m1/s1 |
| InChIKey | BGOLIABNPGKXRB-LPBYPYPOSA-N |
| Mol Weight | 684.8 g/mol |
| Molecular Formula | C37H52N2O10 |
| Exact Mass | 684.362196 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 94CYEW0QCWq |
|---|---|
| Name | ISOPROPYLELEUTHEROBIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H52N2O10 |
| InChI | InChI=1S/C37H52N2O10/c1-21(2)27-11-9-23(5)28-16-31(47-32(42)12-10-26-17-39(8)20-38-26)36(7)13-14-37(49-36,48-22(3)4)25(15-29(27)28)18-44-35-34(46-24(6)40)33(43)30(41)19-45-35/h9-10,12-15,17,20-22,27-31,33-35,41,43H,11,16,18-19H2,1-8H3/b12-10+,25-15-/t27-,28+,29-,30-,31+,33-,34+,35-,36+,37-/m1/s1 |
| InChIKey | BGOLIABNPGKXRB-LPBYPYPOSA-N |
| Literature Reference Author | R.BRITTON,E.D.D.SILVA,C.M.BIGG,L.M.MCHARDY,M.ROBERGE,R.J.AND ERSEN |
| Literature Reference Citation | J.AM.CHEM.SOC.,123,8632(2001) |
| Literature Reference DOI | 10.1021/ja016459q |
| Molecular Weight | 684.827 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN30285 |