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BASTADIN_6

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BASTADIN_6
SpectraBase Compound ID 8JrC4XFN3m9
InChI InChI=1S/C34H26Br6N4O8/c35-19-5-16-2-4-42-33(47)25(43-49)11-17-9-23(39)32(24(40)10-17)52-28-14-18(8-20(36)30(28)46)12-26(44-50)34(48)41-3-1-15-6-21(37)31(22(38)7-15)51-27(13-16)29(19)45/h5-10,13-14,45-46,49-50H,1-4,11-12H2,(H,41,48)(H,42,47)/b43-25-,44-26+
InChIKey WSOCBHDTRCSWRH-OBWYSMLFSA-N
Mol Weight 1098.0 g/mol
Molecular Formula C34H26Br6N4O8
Exact Mass 1091.685092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7svrdurcVik
Name BASTADIN_6
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H24Br6N4O8
InChI InChI=1S/C34H26Br6N4O8/c35-19-5-16-2-4-42-33(47)25(43-49)11-17-9-23(39)32(24(40)10-17)52-28-14-18(8-20(36)30(28)46)12-26(44-50)34(48)41-3-1-15-6-21(37)31(22(38)7-15)51-27(13-16)29(19)45/h5-10,13-14,45-46,49-50H,1-4,11-12H2,(H,41,48)(H,42,47)/b43-25-,44-26+
InChIKey WSOCBHDTRCSWRH-OBWYSMLFSA-N
Literature Reference Author H.GREVE,S.KEHRAUS,A.KRICK,G.KELTER,A.MAIER,H.H.FIEBIG,A.D.WR IGHT,G.M.KOENIG
Literature Reference Citation J.NAT.PROD.,71,309(2008)
Literature Reference DOI 10.1021/np070373e
Molecular Weight 1096.011 g/mol
Sample ID 27479
Solvent ACETONE-D6