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LYSOCELLIN-RETROALDOL-KETONE;ALPHA/BETA-MIXTURE
SpectraBase Compound ID 12rQ2xUJ3Vb
InChI InChI=1S/2C22H40O5/c2*1-8-16(17(23)9-2)19-14(5)12-20(7,26-19)22(25)15(6)13-21(11-4,27-22)18(24)10-3/h2*14-16,18-19,24-25H,8-13H2,1-7H3/t14-,15+,16+,18-,19-,20-,21+,22+;14-,15+,16-,18-,19-,20-,21+,22+/m00/s1
InChIKey BBEZWBREUKPDTC-PFXAACRXSA-N
Mol Weight 769.1 g/mol
Molecular Formula C44H80O10
Exact Mass 768.575149 g/mol
Enantiomer InChIKey BBEZWBREUKPDTC-SSXZKZCVSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
The assignment of the 13C-NMR spectrum of lysocellin and its biosynthesis. Agricultural and Biological Chemistry 1978

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