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25-CYCLOHEXYL-AVERMECTIN-B2
SpectraBase Compound ID 8EQTrCU7US8
InChI InChI=1S/C50H76O15/c1-26-13-12-16-33-25-58-47-42(52)28(3)19-36(50(33,47)55)48(54)61-35-20-34(64-49(23-35)24-37(51)29(4)45(65-49)32-14-10-9-11-15-32)18-17-27(2)44(26)62-41-22-39(57-8)46(31(6)60-41)63-40-21-38(56-7)43(53)30(5)59-40/h12-13,16-17,19,26,29-32,34-47,51-53,55H,9-11,14-15,18,20-25H2,1-8H3/b13-12+,27-17+,33-16+/t26-,29-,30-,31-,34+,35-,36+,37-,38-,39-,40-,41-,42?,43-,44-,45-,46-,47+,49-,50+/m0/s1
InChIKey RKKKCJRJZJRXCV-HQXLDFGSSA-N
Mol Weight 917.1 g/mol
Molecular Formula C50H76O15
Exact Mass 916.518422 g/mol
Enantiomer InChIKey RKKKCJRJZJRXCV-FVEWPLNTSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Structure of doramectin Journal of the Chemical Society, Perkin Transactions 2 1995

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