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Chetomin
SpectraBase Compound ID Lo5PtOO2wQa
InChI InChI=1S/C31H30N6O6S4/c1-33-25(42)30(15-38)34(2)23(40)28(33,44-46-30)12-17-13-36(21-11-7-4-8-18(17)21)27-14-29-24(41)35(3)31(16-39,47-45-29)26(43)37(29)22(27)32-20-10-6-5-9-19(20)27/h4-11,13,22,32,38-39H,12,14-16H2,1-3H3/t22?,27?,28-,29?,30-,31?/m0/s1
InChIKey ZRZWBWPDBOVIGQ-ZCRPTDDBSA-N
Mol Weight 710.9 g/mol
Molecular Formula C31H30N6O6S4
Exact Mass 710.110967 g/mol
Enantiomer InChIKey ZRZWBWPDBOVIGQ-PZZDNIGBSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Sporidesmins. Part 16. The structure of chetomin, a toxic metabolite of Chaetomium cochliodes, by nitrogen-15 and carbon-13 nuclear magnetic resonance spectroscopy Journal of the Chemical Society, Perkin Transactions 1 1978

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