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Wikstrotoxin C
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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1cwsrgg80lb
Name WIKSTROTOXIN-C
Compound Number 57
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 UWIR13506