| SpectraBase Compound ID | 2SN7yMrdkU8 |
|---|---|
| InChI | InChI=1S/C35H52N2O10/c1-20(2)25-10-8-21(3)26-15-29(46-30(40)11-9-24-16-37(6)19-36-24)34(5)12-13-35(42-7,47-34)23(14-27(25)26)17-43-33-32(45-22(4)38)31(41)28(39)18-44-33/h9,11,14,16,19-21,25-29,31-33,39,41H,8,10,12-13,15,17-18H2,1-7H3/b11-9+,23-14-/t21-,25+,26-,27+,28+,29-,31+,32-,33+,34-,35+/m0/s1 |
| InChIKey | NFEUWFOVNSLTGQ-DZUFEKSVSA-N |
| Mol Weight | 660.8 g/mol |
| Molecular Formula | C35H52N2O10 |
| Exact Mass | 660.362196 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4W1uwJXZBPl |
|---|---|
| Name | 5,6,11,12-TETRAHYDRO-ELEUTHEROBIN |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H52N2O10 |
| InChI | InChI=1S/C35H52N2O10/c1-20(2)25-10-8-21(3)26-15-29(46-30(40)11-9-24-16-37(6)19-36-24)34(5)12-13-35(42-7,47-34)23(14-27(25)26)17-43-33-32(45-22(4)38)31(41)28(39)18-44-33/h9,11,14,16,19-21,25-29,31-33,39,41H,8,10,12-13,15,17-18H2,1-7H3/b11-9+,23-14-/t21-,25+,26-,27+,28+,29-,31+,32-,33+,34-,35+/m0/s1 |
| InChIKey | NFEUWFOVNSLTGQ-DZUFEKSVSA-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 | 660.805 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN30277 |