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BASTADIN-14
SpectraBase Compound ID 5rk7Y9Y6XDp
InChI InChI=1S/C34H25Br5N4O8/c35-20-7-16-1-2-27(20)50-28-15-19(11-22(37)30(28)44)13-26(43-49)34(47)40-5-3-17-9-23(38)32(24(39)10-17)51-29-14-18(8-21(36)31(29)45)4-6-41-33(46)25(12-16)42-48/h1-3,5,7-11,14-15,44-45,48-49H,4,6,12-13H2,(H,40,47)(H,41,46)/b5-3+,42-25-,43-26-
InChIKey HXWATZFIMWEHEG-GLKJARMSSA-N
Mol Weight 1017.1 g/mol
Molecular Formula C34H25Br5N4O8
Exact Mass 1011.758929 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AgNEXocF3bk
Name BASTADIN-14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H23Br5N4O8
InChI InChI=1S/C34H25Br5N4O8/c35-20-7-16-1-2-27(20)50-28-15-19(11-22(37)30(28)44)13-26(43-49)34(47)40-5-3-17-9-23(38)32(24(39)10-17)51-29-14-18(8-21(36)31(29)45)4-6-41-33(46)25(12-16)42-48/h1-3,5,7-11,14-15,44-45,48-49H,4,6,12-13H2,(H,40,47)(H,41,46)/b5-3+,42-25-,43-26-
InChIKey HXWATZFIMWEHEG-GLKJARMSSA-N
Literature Reference Author J.R.CARNEY,P.J.SCHEUER,M.KELLY-BORGES
Literature Reference Citation J.NAT.PROD.,56,153(1993)
Literature Reference DOI 10.1021/np50091a025
Molecular Weight 1015.099 g/mol
Solvent DMSO-D6
Source File Reference UWTS1237