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CYCLOFORSKAMIDE
SpectraBase Compound ID 7iXERUVh1Rx
InChI InChI=1S/C54H86N12O11S3/c1-13-27(9)39-52-57-33(23-80-52)45(71)63-41(29(11)67)49(75)60-37(25(5)6)46(72)59-38(26(7)8)48(74)64-42(30(12)68)54(77)66-20-16-18-35(66)51-56-32(22-79-51)44(70)62-40(28(10)14-2)53(76)65-19-15-17-34(65)50-55-31(21-78-50)43(69)58-36(24(3)4)47(73)61-39/h24-42,67-68H,13-23H2,1-12H3,(H,58,69)(H,59,72)(H,60,75)(H,61,73)(H,62,70)(H,63,71)(H,64,74)/t27-,28?,29+,30+,31-,32-,33-,34+,35+,36-,37-,38-,39+,40-,41-,42-/m0/s1
InChIKey LCNUZNAEJUHWTH-GTSAYDOJSA-N
Mol Weight 1175.5 g/mol
Molecular Formula C54H86N12O11S3
Exact Mass 1174.570115 g/mol
Enantiomer InChIKey LCNUZNAEJUHWTH-CWJDANTLSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Cycloforskamide, a Cytotoxic Macrocyclic Peptide from the Sea Slug Pleurobranchus forskalii Journal of Natural Products 2013

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