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2,3,4,7-TETRA-O-ACETYL-1'-DEMETHYLLINOMYCIN

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2,3,4,7-TETRA-O-ACETYL-1'-DEMETHYLLINOMYCIN
SpectraBase Compound ID ABqVlGi0mPj
InChI InChI=1S/C25H40N2O10S/c1-8-9-17-10-18(26-11-17)24(32)27-19(12(2)33-13(3)28)20-21(34-14(4)29)22(35-15(5)30)23(36-16(6)31)25(37-20)38-7/h12,17-23,25-26H,8-11H2,1-7H3,(H,27,32)/t12?,17-,18+,19?,20+,21-,22-,23+,25+/m0/s1
InChIKey JQLLRRDKTMCHAD-NJOJPRBZSA-N
Mol Weight 560.7 g/mol
Molecular Formula C25H40N2O10S
Exact Mass 560.240367 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L03ZSaBfEvJ
Name 2,3,4,7-TETRA-O-ACETYL-1'-DEMETHYLLINOMYCIN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40N2O10S
InChI InChI=1S/C25H40N2O10S/c1-8-9-17-10-18(26-11-17)24(32)27-19(12(2)33-13(3)28)20-21(34-14(4)29)22(35-15(5)30)23(36-16(6)31)25(37-20)38-7/h12,17-23,25-26H,8-11H2,1-7H3,(H,27,32)/t12?,17-,18+,19?,20+,21-,22-,23+,25+/m0/s1
InChIKey JQLLRRDKTMCHAD-NJOJPRBZSA-N
Literature Reference Author S.DELOISY,A.OLESKER,G.LUKACS
Literature Reference Citation HETEROCYCLES,41,259(1995)
Literature Reference DOI 10.3987/COM-94-6831
Molecular Weight 560.660 g/mol
Solvent CDCl3
Source File Reference UWCP4531