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3-O-BETA-D-(2,3,4,6-TETRAACETOXY)-GLUCOPYRANOSYL-(1->2)-BETA-D-(3,4-DIACETOXY)-GLUCURONOPYRANOSYL-(1->6)-BETA-D-(2,3,4-TRIACETOXY)-GLUCOPYRANOSYL-2

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3-O-BETA-D-(2,3,4,6-TETRAACETOXY)-GLUCOPYRANOSYL-(1->2)-BETA-D-(3,4-DIACETOXY)-GLUCURONOPYRANOSYL-(1->6)-BETA-D-(2,3,4-TRIACETOXY)-GLUCOPYRANOSYL-2
SpectraBase Compound ID AhYbRUzSqDU
InChI InChI=1S/C77H108O35/c1-34(78)93-31-49-54(97-36(3)80)58(101-40(7)84)65(106-45(12)89)70(108-49)111-63-60(103-42(9)86)59(102-41(8)85)61(66(90)91)110-67(63)94-33-50-55(98-37(4)81)57(100-39(6)83)64(105-44(11)88)69(107-50)109-53-23-24-74(17)51(73(53,15)16)22-25-76(19)52(74)21-20-46-47-30-72(13,14)26-28-77(47,29-27-75(46,76)18)71(92)112-68-62(104-43(10)87)56(99-38(5)82)48(32-95-68)96-35(2)79/h20,47-65,67-70H,21-33H2,1-19H3,(H,90,91)/t47-,48+,49+,50+,51-,52+,53-,54+,55+,56-,57-,58-,59-,60-,61-,62+,63+,64+,65+,67+,68-,69-,70-,74-,75+,76+,77-/m0/s1
InChIKey GMQQGVLCLINRLM-RZSKCXMWSA-N
Mol Weight 1593.7 g/mol
Molecular Formula C77H108O35
Exact Mass 1592.667115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9sXJ73gKsrH
Name 3-O-BETA-D-(2,3,4,6-TETRAACETOXY)-GLUCOPYRANOSYL-(1->2)-BETA-D-(3,4-DIACETOXY)-GLUCURONOPYRANOSYL-(1->6)-BETA-D-(2,3,4-TRIACETOXY)-GLUCOPYRANOSYL-2
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C77H108O35
InChI InChI=1S/C77H108O35/c1-34(78)93-31-49-54(97-36(3)80)58(101-40(7)84)65(106-45(12)89)70(108-49)111-63-60(103-42(9)86)59(102-41(8)85)61(66(90)91)110-67(63)94-33-50-55(98-37(4)81)57(100-39(6)83)64(105-44(11)88)69(107-50)109-53-23-24-74(17)51(73(53,15)16)22-25-76(19)52(74)21-20-46-47-30-72(13,14)26-28-77(47,29-27-75(46,76)18)71(92)112-68-62(104-43(10)87)56(99-38(5)82)48(32-95-68)96-35(2)79/h20,47-65,67-70H,21-33H2,1-19H3,(H,90,91)/t47-,48+,49+,50+,51-,52+,53-,54+,55+,56-,57-,58-,59-,60-,61-,62+,63+,64+,65+,67+,68-,69-,70-,74-,75+,76+,77-/m0/s1
InChIKey GMQQGVLCLINRLM-RZSKCXMWSA-N
Literature Reference Author Y.N.SHUKLA,R.S.THAKUR,P.PACHALY
Literature Reference Citation PHYTOCHEM.,31,1046(1992)
Literature Reference DOI 10.1016/0031-9422(92)80071-l
Molecular Weight 1593.684 g/mol
Solvent Unknown
Source File Reference UWVN5057