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Echinulin
SpectraBase Compound ID 3t2ORdIP3QK
InChI InChI=1S/C29H39N3O2/c1-9-29(7,8)26-23(16-24-28(34)30-19(6)27(33)31-24)22-15-20(12-10-17(2)3)14-21(25(22)32-26)13-11-18(4)5/h9-11,14-15,19,24,32H,1,12-13,16H2,2-8H3,(H,30,34)(H,31,33)/t19-,24-/m0/s1
InChIKey DIKMWTRJIZQJMY-CYFREDJKSA-N
Mol Weight 461.7 g/mol
Molecular Formula C29H39N3O2
Exact Mass 461.304228 g/mol
Enantiomer InChIKey DIKMWTRJIZQJMY-NTKDMRAZSA-N
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum BS-4-25-0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
  • (3S,6S)-3-methyl-6-[[2-(2-methylbut-3-en-2-yl)-5,7-bis(3-methylbut-2-enyl)-1H-indol-3-yl]methyl]piperazine-2,5-dione
  • (3S,6S)-3-[[2-(1,1-Dimethyl-2-propen-1-yl)-5,7-bis(3-methyl-2-buten-1-yl)-1H-indol-3-yl]methyl]-6-\rmethyl-2,5-piperazinedione
Title Journal or Book Year
13C-NMR spectra and streochemistry of isoechinulins A, B and C. Agricultural and Biological Chemistry 1979

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