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E-DEHYDROAPRATOXIN-A;MAJOR-CONFORMER
SpectraBase Compound ID 4Pn4h7Lc40Z
InChI InChI=1S/C45H67N5O7S/c1-13-28(3)38-43(54)50-22-14-15-36(50)44(55)57-37(45(7,8)9)23-27(2)16-17-29(4)40-46-33(26-58-40)24-30(5)39(51)47-35(25-32-18-20-34(56-12)21-19-32)42(53)48(10)31(6)41(52)49(38)11/h17-21,24,27-28,31,33,35-38H,13-16,22-23,25-26H2,1-12H3,(H,47,51)/b29-17+,30-24+/t27-,28-,31-,33-,35-,36-,37-,38-/m0/s1
InChIKey RDTKVQUPKFRZEV-SNTCAYBKSA-N
Mol Weight 822.1 g/mol
Molecular Formula C45H67N5O7S
Exact Mass 821.476121 g/mol
Enantiomer InChIKey RDTKVQUPKFRZEV-YFUASSRDSA-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
  • E-DEHYDROAPRATOXIN-A;MINOR-CONFORMER
Title Journal or Book Year
New apratoxins of marine cyanobacterial origin from guam and palau Bioorganic & Medicinal Chemistry 2002

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