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TETRAMETHYLETHER-OF-BASTADIN-21
SpectraBase Compound ID HlHL7ERbrk7
InChI InChI=1S/C38H37Br3N4O8/c1-48-33-10-6-23-12-14-43-38(47)30(45-51-4)19-25-17-28(41)36(49-2)35(21-25)53-32-9-7-24(16-27(32)40)18-29(44-50-3)37(46)42-13-11-22-5-8-31(26(39)15-22)52-34(33)20-23/h5-10,15-17,20-21H,11-14,18-19H2,1-4H3,(H,42,46)(H,43,47)/b44-29-,45-30+
InChIKey ZPMYGNUXYVLYBW-SLWSUCMKSA-N
Mol Weight 917.4 g/mol
Molecular Formula C38H37Br3N4O8
Exact Mass 914.016153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gkxx0HnQGGK
Name TETRAMETHYLETHER-OF-BASTADIN-21
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H37Br3N4O8
InChI InChI=1S/C38H37Br3N4O8/c1-48-33-10-6-23-12-14-43-38(47)30(45-51-4)19-25-17-28(41)36(49-2)35(21-25)53-32-9-7-24(16-27(32)40)18-29(44-50-3)37(46)42-13-11-22-5-8-31(26(39)15-22)52-34(33)20-23/h5-10,15-17,20-21H,11-14,18-19H2,1-4H3,(H,42,46)(H,43,47)/b44-29-,45-30+
InChIKey ZPMYGNUXYVLYBW-SLWSUCMKSA-N
Literature Reference Author J.C.COLL,P.S.KEARNS,J.A.RIDEOUT,V.SANKAR
Literature Reference Citation J.NAT.PROD.,65,753(2002)
Literature Reference DOI 10.1021/np010520n
Molecular Weight 917.446 g/mol
Solvent CDCl3
Source File Reference UWSI4240