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BIS-[6-(5,6-DIHYDROSANGUILUTINYL)]-ETHER

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BIS-[6-(5,6-DIHYDROSANGUILUTINYL)]-ETHER
SpectraBase Compound ID Ie9ZBuOPpP1
InChI InChI=1S/C46H48N2O11/c1-47-41-25(15-13-23-17-29(49-3)31(51-5)19-27(23)41)37-33(53-7)21-35(55-9)43(57-11)39(37)45(47)59-46-40-38(34(54-8)22-36(56-10)44(40)58-12)26-16-14-24-18-30(50-4)32(52-6)20-28(24)42(26)48(46)2/h13-22,45-46H,1-12H3
InChIKey JJMRLIRRFAVZGA-UHFFFAOYSA-N
Mol Weight 804.9 g/mol
Molecular Formula C46H48N2O11
Exact Mass 804.32581 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5VAFDYEluXX
Name BIS-[6-(5,6-DIHYDROSANGUILUTINYL)]-ETHER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H48N2O11
InChI InChI=1S/C46H48N2O11/c1-47-41-25(15-13-23-17-29(49-3)31(51-5)19-27(23)41)37-33(53-7)21-35(55-9)43(57-11)39(37)45(47)59-46-40-38(34(54-8)22-36(56-10)44(40)58-12)26-16-14-24-18-30(50-4)32(52-6)20-28(24)42(26)48(46)2/h13-22,45-46H,1-12H3
InChIKey JJMRLIRRFAVZGA-UHFFFAOYSA-N
Literature Reference Author J.DOSTAL,J.SLAVIK,M.POTACEK,R.MAREK,V.SKLENAR,E.D.HOFFMANN,R .ROZENBERG,B.TINANT,
Literature Reference Citation PHYTOCHEM.,47,879(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00665-1
Molecular Weight 804.894 g/mol
Solvent CDCl3
Source File Reference UWMS404