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MYCOTHIAZOLE-4,19-DIOL
SpectraBase Compound ID 1N4x0IGQXft
InChI InChI=1S/C22H34N2O5S/c1-5-6-7-8-10-17-15-30-19(24-17)21(2,3)18(26)11-9-12-22(28,16-25)13-14-23-20(27)29-4/h5,7-9,12,15,18,25-26,28H,1,6,10-11,13-14,16H2,2-4H3,(H,23,27)/b8-7-,12-9+/t18-,22?/m0/s1
InChIKey RLXUGGXKLZEBBM-ZZIRFIJCSA-N
Mol Weight 438.6 g/mol
Molecular Formula C22H34N2O5S
Exact Mass 438.218843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 30h4VgBH106
Name MYCOTHIAZOLE-4,19-DIOL
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34N2O5S
InChI InChI=1S/C22H34N2O5S/c1-5-6-7-8-10-17-15-30-19(24-17)21(2,3)18(26)11-9-12-22(28,16-25)13-14-23-20(27)29-4/h5,7-9,12,15,18,25-26,28H,1,6,10-11,13-14,16H2,2-4H3,(H,23,27)/b8-7-,12-9+/t18-,22?/m0/s1
InChIKey RLXUGGXKLZEBBM-ZZIRFIJCSA-N
Literature Reference Author R.N.SONNENSCHEIN,T.A.JOHNSON,K.TENNEY,F.A.VALERIOTE,P.CREWS
Literature Reference Citation J.NAT.PROD.,69,145(2006)
Literature Reference DOI 10.1021/np0503597
Molecular Weight 438.582 g/mol
Solvent DMSO-D6
Source File Reference UWMZ16728