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PSAMMAPLYSIN_N

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PSAMMAPLYSIN_N
SpectraBase Compound ID CLygkY5TWYd
InChI InChI=1S/C37H53Br4N3O7/c1-25(2)15-12-10-8-6-4-5-7-9-11-13-16-31(45)42-19-17-26-21-27(38)34(28(39)22-26)49-20-14-18-43-36(47)32-35(46)37(51-44-32)23-29(40)33(48-3)30(41)24-50-37/h21-22,24-25,35,46H,4-20,23H2,1-3H3,(H,42,45)(H,43,47)/t35-,37+/m0/s1
InChIKey FULHUJNOWYYQIB-YBZKQSBQSA-N
Mol Weight 971.5 g/mol
Molecular Formula C37H53Br4N3O7
Exact Mass 967.061703 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iz3UgmGHK05
Name PSAMMAPLYSIN_N
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H53Br4N3O7
InChI InChI=1S/C37H53Br4N3O7/c1-25(2)15-12-10-8-6-4-5-7-9-11-13-16-31(45)42-19-17-26-21-27(38)34(28(39)22-26)49-20-14-18-43-36(47)32-35(46)37(51-44-32)23-29(40)33(48-3)30(41)24-50-37/h21-22,24-25,35,46H,4-20,23H2,1-3H3,(H,42,45)(H,43,47)/t35-,37+/m0/s1
InChIKey FULHUJNOWYYQIB-YBZKQSBQSA-N
Literature Reference Author I.W.MUDIANTA,T.SKINNER-ADAMS,K.T.ANDREWS,R.A.DAVIS,T.A.HADI, P.Y.HAYES,M.J.GARSON
Literature Reference Citation J.NAT.PROD.,75,2132(2012)
Literature Reference DOI 10.1021/np300560b
Molecular Weight 971.460 g/mol
Sample ID 41734
Solvent CDCl3