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#2;3-BETA-O-{ALPHA-L-XYLOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->2)}-ALPHA-LARABINOPYRANOSYL}-16-ALPHA-HYDROXY-13-BETA,28-E
SpectraBase Compound ID CpLnJl2xUoy
InChI InChI=1S/C52H86O21/c1-46(2)14-15-51-22-67-52(29(51)16-46)13-9-28-48(5)11-10-31(47(3,4)27(48)8-12-49(28,6)50(52,7)17-30(51)56)71-44-40(73-43-39(64)36(61)33(58)24(18-53)68-43)35(60)26(21-66-44)70-45-41(37(62)34(59)25(19-54)69-45)72-42-38(63)32(57)23(55)20-65-42/h23-45,53-64H,8-22H2,1-7H3/t23-,24+,25+,26+,27-,28+,29+,30+,31-,32+,33+,34+,35-,36-,37-,38-,39+,40+,41+,42+,43-,44-,45-,48-,49+,50-,51+,52-/m0/s1
InChIKey GQENXAKENMICMF-DCMMJMHLSA-N
Mol Weight 1047.2 g/mol
Molecular Formula C52H86O21
Exact Mass 1046.56616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GYNWhQavYb8
Name #2;3-BETA-O-{ALPHA-L-XYLOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->2)}-ALPHA-LARABINOPYRANOSYL}-16-ALPHA-HYDROXY-13-BETA,28-E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H86O21
InChI InChI=1S/C52H86O21/c1-46(2)14-15-51-22-67-52(29(51)16-46)13-9-28-48(5)11-10-31(47(3,4)27(48)8-12-49(28,6)50(52,7)17-30(51)56)71-44-40(73-43-39(64)36(61)33(58)24(18-53)68-43)35(60)26(21-66-44)70-45-41(37(62)34(59)25(19-54)69-45)72-42-38(63)32(57)23(55)20-65-42/h23-45,53-64H,8-22H2,1-7H3/t23-,24+,25+,26+,27-,28+,29+,30+,31-,32+,33+,34+,35-,36-,37-,38-,39+,40+,41+,42+,43-,44-,45-,48-,49+,50-,51+,52-/m0/s1
InChIKey GQENXAKENMICMF-DCMMJMHLSA-N
Literature Reference Author S.J.BLOOR,L.QI
Literature Reference Citation J.NAT.PROD.,57,1354(1994)
Literature Reference DOI 10.1021/np50112a004
Molecular Weight 1047.242 g/mol
Solvent C5D5N
Source File Reference UWTS2618