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(3,4-DIACETOXYPHENYL)-2-ETHYL-[TRIACETYL-ALPHA-L-ARABINOPYRANOSYL-(1->2)-DIACETYL-ALPHA-L-RHAMNOPYRANOSYL-(1->3)]-TRIACETYL-BETA-D-APIOFURANOSYL-(1
SpectraBase Compound ID HD51EMxXKdG
InChI InChI=1S/C65H78O36/c1-29-52(91-36(8)72)55(93-38(10)74)59(100-62-57(94-39(11)75)54(92-37(9)73)49(25-81-62)90-35(7)71)63(85-29)99-56-53(98-51(79)20-17-43-15-18-45(86-31(3)67)47(23-43)88-33(5)69)50(26-82-64-60(96-41(13)77)65(28-84-64,101-42(14)78)27-83-30(2)66)97-61(58(56)95-40(12)76)80-22-21-44-16-19-46(87-32(4)68)48(24-44)89-34(6)70/h15-20,23-24,29,49-50,52-64H,21-22,25-28H2,1-14H3/b20-17+/t29-,49-,50-,52-,53-,54-,55+,56+,57+,58-,59+,60-,61-,62-,63-,64+,65+/m0/s1
InChIKey NMTHQWQYEAVVRR-YTKVBMBGSA-N
Mol Weight 1435.3 g/mol
Molecular Formula C65H78O36
Exact Mass 1434.427279 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G3aCbTFEbE0
Name (3,4-DIACETOXYPHENYL)-2-ETHYL-[TRIACETYL-ALPHA-L-ARABINOPYRANOSYL-(1->2)-DIACETYL-ALPHA-L-RHAMNOPYRANOSYL-(1->3)]-TRIACETYL-BETA-D-APIOFURANOSYL-(1
Compound Number 2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C65H78O36
InChI InChI=1S/C65H78O36/c1-29-52(91-36(8)72)55(93-38(10)74)59(100-62-57(94-39(11)75)54(92-37(9)73)49(25-81-62)90-35(7)71)63(85-29)99-56-53(98-51(79)20-17-43-15-18-45(86-31(3)67)47(23-43)88-33(5)69)50(26-82-64-60(96-41(13)77)65(28-84-64,101-42(14)78)27-83-30(2)66)97-61(58(56)95-40(12)76)80-22-21-44-16-19-46(87-32(4)68)48(24-44)89-34(6)70/h15-20,23-24,29,49-50,52-64H,21-22,25-28H2,1-14H3/b20-17+/t29-,49-,50-,52-,53-,54-,55+,56+,57+,58-,59+,60-,61-,62-,63-,64+,65+/m0/s1
InChIKey NMTHQWQYEAVVRR-YTKVBMBGSA-N
Literature Reference Author V.SEIDEL,F.BAILLEUL,F.LIBOT,F.TILLEQUIN
Literature Reference Citation PHYTOCHEM.,44,691(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00578-X
Molecular Weight 1435.313 g/mol
Solvent CDCl3
Source File Reference UWPA243