| SpectraBase Compound ID | FOker7xXbNk |
|---|---|
| InChI | InChI=1S/C46H54O13/c1-25-22-32-43(52)35(25)55-33(48)17-11-10-16-31(54-39(49)29-12-6-4-7-13-29)28-20-18-27(19-21-28)23-41(3,51)45(53)36-26(2)44(32)34(37-42(24-47,56-37)40(43)50)38(45)58-46(57-36,59-44)30-14-8-5-9-15-30/h4-17,25-28,31-32,34-38,40,47,50-53H,18-24H2,1-3H3/b16-10-,17-11+/t25-,26+,27?,28?,31+,32+,34-,35-,36-,37-,38+,40+,41+,42-,43+,44-,45-,46+/m0/s1 |
| InChIKey | VAEBJJRRTFBWLJ-CAGPDKTLSA-N |
| Mol Weight | 814.9 g/mol |
| Molecular Formula | C46H54O13 |
| Exact Mass | 814.356442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ciln5KUzUz8 |
|---|---|
| Name | REDIOCIDE-G |
| Compound Number | 80 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H54O13 |
| InChI | InChI=1S/C46H54O13/c1-25-22-32-43(52)35(25)55-33(48)17-11-10-16-31(54-39(49)29-12-6-4-7-13-29)28-20-18-27(19-21-28)23-41(3,51)45(53)36-26(2)44(32)34(37-42(24-47,56-37)40(43)50)38(45)58-46(57-36,59-44)30-14-8-5-9-15-30/h4-17,25-28,31-32,34-38,40,47,50-53H,18-24H2,1-3H3/b16-10-,17-11+/t25-,26+,27?,28?,31+,32+,34-,35-,36-,37-,38+,40+,41+,42-,43+,44-,45-,46+/m0/s1 |
| InChIKey | VAEBJJRRTFBWLJ-CAGPDKTLSA-N |
| Literature Reference Author | H.B.WANG,L.P.LIU,X.Y.WANG |
| Literature Reference Citation | MAGN.RES.CHEM.,51,580(2013) |
| Literature Reference DOI | 10.1002/mrc.3978 |
| Molecular Weight | 814.927 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR13531 |