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ILEXOSIDE_VI;3-O-ALPHA-L-ARABINOPYRANOSYL-POMOLIC_ACID_28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID AK3Y6l5ElO2
InChI InChI=1S/C53H86O22/c1-22-11-16-53(47(66)75-46-41(74-45-40(65)35(60)31(56)23(2)70-45)37(62)34(59)27(72-46)21-69-43-39(64)36(61)33(58)26(19-54)71-43)18-17-50(6)24(42(53)52(22,8)67)9-10-29-49(5)14-13-30(48(3,4)28(49)12-15-51(29,50)7)73-44-38(63)32(57)25(55)20-68-44/h9,22-23,25-46,54-65,67H,10-21H2,1-8H3/t22-,23+,25+,26-,27-,28+,29-,30+,31+,32+,33-,34-,35-,36+,37+,38-,39-,40-,41-,42-,43-,44+,45+,46+,49+,50-,51-,52-,53+/m1/s1
InChIKey YAVJCXKCVJVCLN-WKKRGLSKSA-N
Mol Weight 1075.2 g/mol
Molecular Formula C53H86O22
Exact Mass 1074.561074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3XG6aWRBoiC
Name ILEXOSIDE_VI;3-O-ALPHA-L-ARABINOPYRANOSYL-POMOLIC_ACID_28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C53H86O22
InChI InChI=1S/C53H86O22/c1-22-11-16-53(47(66)75-46-41(74-45-40(65)35(60)31(56)23(2)70-45)37(62)34(59)27(72-46)21-69-43-39(64)36(61)33(58)26(19-54)71-43)18-17-50(6)24(42(53)52(22,8)67)9-10-29-49(5)14-13-30(48(3,4)28(49)12-15-51(29,50)7)73-44-38(63)32(57)25(55)20-68-44/h9,22-23,25-46,54-65,67H,10-21H2,1-8H3/t22-,23+,25+,26-,27-,28+,29-,30+,31+,32+,33-,34-,35-,36+,37+,38-,39-,40-,41-,42-,43-,44+,45+,46+,49+,50-,51-,52-,53+/m1/s1
InChIKey YAVJCXKCVJVCLN-WKKRGLSKSA-N
Literature Reference Author T.KAKUNO,K.YOSHIKAWA,S.ARIHARA
Literature Reference Citation PHYTOCHEM.,31,2809(1992)
Literature Reference DOI 10.1016/0031-9422(92)83636-D
Molecular Weight 1075.253 g/mol
Solvent C5D5N
Source File Reference UWMZ23277