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PSAMMAPLYSIN_S

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PSAMMAPLYSIN_S
SpectraBase Compound ID ChxlkpRWqD3
InChI InChI=1S/C38H55Br4N3O7/c1-4-26(2)16-13-11-9-7-5-6-8-10-12-14-17-32(46)43-20-18-27-22-28(39)35(29(40)23-27)50-21-15-19-44-37(48)33-36(47)38(52-45-33)24-30(41)34(49-3)31(42)25-51-38/h22-23,25-26,36,47H,4-21,24H2,1-3H3,(H,43,46)(H,44,48)/t26?,36-,38+/m0/s1
InChIKey PBIFLCIWIOWNOI-OJWFORPGSA-N
Mol Weight 985.5 g/mol
Molecular Formula C38H55Br4N3O7
Exact Mass 981.077353 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CnWCrZ8F2ty
Name PSAMMAPLYSIN_S
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H55Br4N3O7
InChI InChI=1S/C38H55Br4N3O7/c1-4-26(2)16-13-11-9-7-5-6-8-10-12-14-17-32(46)43-20-18-27-22-28(39)35(29(40)23-27)50-21-15-19-44-37(48)33-36(47)38(52-45-33)24-30(41)34(49-3)31(42)25-51-38/h22-23,25-26,36,47H,4-21,24H2,1-3H3,(H,43,46)(H,44,48)/t26?,36-,38+/m0/s1
InChIKey PBIFLCIWIOWNOI-OJWFORPGSA-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 985.487 g/mol
Sample ID 41725
Solvent CDCl3