John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=AGqqbV94clq SpectraBase Spectrum ID=10mhSbEohQb

(accessed ).
5-O-(TERT.-BUTYLDIMETHYLSILYL)-IVERMECTIN-ISOAMYL-SECOESTER
SpectraBase Compound ID AGqqbV94clq
InChI InChI=1S/C59H100O15Si/c1-18-35(4)52-38(7)24-26-58(73-52)32-43(60)29-44(72-58)23-22-37(6)51(70-49-31-47(65-15)54(41(10)69-49)71-48-30-46(64-14)50(61)40(9)68-48)36(5)20-19-21-42-33-67-55-53(74-75(16,17)57(11,12)13)39(8)28-45(59(42,55)63)56(62)66-27-25-34(2)3/h19-22,28,34-36,38,40-41,43-55,60-61,63H,18,23-27,29-33H2,1-17H3/b20-19+,37-22+,42-21+/t35-,36-,38+,40+,41-,43+,44-,45-,46+,47-,48+,49-,50+,51-,52-,53+,54-,55+,58-,59+/m1/s1
InChIKey ZBWJVVLFHLDVOU-DGKYPPNRSA-N
Mol Weight 1077.5 g/mol
Molecular Formula C59H100O15Si
Exact Mass 1076.683152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10mhSbEohQb
Name 5-O-(TERT.-BUTYLDIMETHYLSILYL)-IVERMECTIN-ISOAMYL-SECOESTER
Compound Number IAMYL-5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C59H100O15Si
InChI InChI=1S/C59H100O15Si/c1-18-35(4)52-38(7)24-26-58(73-52)32-43(60)29-44(72-58)23-22-37(6)51(70-49-31-47(65-15)54(41(10)69-49)71-48-30-46(64-14)50(61)40(9)68-48)36(5)20-19-21-42-33-67-55-53(74-75(16,17)57(11,12)13)39(8)28-45(59(42,55)63)56(62)66-27-25-34(2)3/h19-22,28,34-36,38,40-41,43-55,60-61,63H,18,23-27,29-33H2,1-17H3/b20-19+,37-22+,42-21+/t35-,36-,38+,40+,41-,43+,44-,45-,46+,47-,48+,49-,50+,51-,52-,53+,54-,55+,58-,59+/m1/s1
InChIKey ZBWJVVLFHLDVOU-DGKYPPNRSA-N
Literature Reference Author A.R.D.SANTOS,M.D.L.G.FERREIRA,C.R.KAISER,J.P.FEREZOU
Literature Reference Citation EUR.J.ORG.CHEM.,3348(2005)
Molecular Weight 1077.519 g/mol
Sample ID 30073
Solvent CDCl3
SpectraBase Batch ID 9WcvAf2kSZG