| SpectraBase Compound ID | 6GLs0DSnEv6 |
|---|---|
| InChI | InChI=1S/C38H52O11/c1-8-9-10-11-12-13-14-15-16-17-18-19-35-45-31-27-30-34(21-39,44-30)32-38(47-33(7,42)46-32)26(20-23(4)28(38)41)37(27,49-35)24(5)29(43-25(6)40)36(31,48-35)22(2)3/h16-20,24,26-27,29-32,39,42H,2,8-15,21H2,1,3-7H3/b17-16+,19-18+/t24-,26+,27+,29-,30+,31-,32-,33+,34+,35+,36+,37+,38-/m1/s1 |
| InChIKey | XMFYGTCNCCVDGI-AJEJXHLPSA-N |
| Mol Weight | 684.8 g/mol |
| Molecular Formula | C38H52O11 |
| Exact Mass | 684.350962 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1suxQk596Ih |
|---|---|
| Name | WIKSTROTOXIN-C |
| Compound Number | 57A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H52O11 |
| InChI | InChI=1S/C38H52O11/c1-8-9-10-11-12-13-14-15-16-17-18-19-35-45-31-27-30-34(21-39,44-30)32-38(47-33(7,42)46-32)26(20-23(4)28(38)41)37(27,49-35)24(5)29(43-25(6)40)36(31,48-35)22(2)3/h16-20,24,26-27,29-32,39,42H,2,8-15,21H2,1,3-7H3/b17-16+,19-18+/t24-,26+,27+,29-,30+,31-,32-,33+,34+,35+,36+,37+,38-/m1/s1 |
| InChIKey | XMFYGTCNCCVDGI-AJEJXHLPSA-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 | 684.824 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR13507 |