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BISFUCOPENTAPHLORETHOL-A-NONADECA-ACETATE;4,3',5'-TRIACETOXY-2,6-BIS-[2,6-DIACETOXY-3-(2,4,6-TRIACETOXYPHENYL)-4-[2,4,6-TRIACETOXYPHENOXY)-PHENOXY]-3,5-DIACETO
SpectraBase Compound ID DeYHrYrk2Vj
InChI InChI=1S/C86H72O43/c1-35(87)106-54-20-55(107-36(2)88)22-56(21-54)125-80-72(128-83-74(121-50(16)102)33-66(126-81-68(117-46(12)98)27-59(110-39(5)91)28-69(81)118-47(13)99)78(85(83)123-52(18)104)76-62(113-42(8)94)23-57(108-37(3)89)24-63(76)114-43(9)95)31-61(112-41(7)93)32-73(80)129-84-75(122-51(17)103)34-67(127-82-70(119-48(14)100)29-60(111-40(6)92)30-71(82)120-49(15)101)79(86(84)124-53(19)105)77-64(115-44(10)96)25-58(109-38(4)90)26-65(77)116-45(11)97/h20-34H,1-19H3
InChIKey ZIELHUHFHKVUND-UHFFFAOYSA-N
Mol Weight 1793.5 g/mol
Molecular Formula C86H72O43
Exact Mass 1792.344731 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1sKehVocEZm
Name BISFUCOPENTAPHLORETHOL-A-NONADECA-ACETATE;4,3',5'-TRIACETOXY-2,6-BIS-[2,6-DIACETOXY-3-(2,4,6-TRIACETOXYPHENYL)-4-[2,4,6-TRIACETOXYPHENOXY)-PHENOXY]-3,5-DIACETO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C86H72O43
InChI InChI=1S/C86H72O43/c1-35(87)106-54-20-55(107-36(2)88)22-56(21-54)125-80-72(128-83-74(121-50(16)102)33-66(126-81-68(117-46(12)98)27-59(110-39(5)91)28-69(81)118-47(13)99)78(85(83)123-52(18)104)76-62(113-42(8)94)23-57(108-37(3)89)24-63(76)114-43(9)95)31-61(112-41(7)93)32-73(80)129-84-75(122-51(17)103)34-67(127-82-70(119-48(14)100)29-60(111-40(6)92)30-71(82)120-49(15)101)79(86(84)124-53(19)105)77-64(115-44(10)96)25-58(109-38(4)90)26-65(77)116-45(11)97/h20-34H,1-19H3
InChIKey ZIELHUHFHKVUND-UHFFFAOYSA-N
Literature Reference Author K.W.GLOMBITZA,M.KEUSGEN,S.HAUPERICH
Literature Reference Citation PHYTOCHEM.,46,1417(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00499-8
Molecular Weight 1793.492 g/mol
Sample ID 45696
Solvent CDCl3