John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=JArTenyaXCH SpectraBase Spectrum ID=10EhwGNrS01

(accessed ).
FRONDOSIDE_A2-7;3-O-{3-O-METHYL-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-(1->4)-[BETA-D-XYLOPYRANOSYL-(1->2)]-BETA-D-QUINOVOPYRANOSYL-(1-
SpectraBase Compound ID JArTenyaXCH
InChI InChI=1S/C61H100O29S.Na/c1-26(2)12-15-38(82-28(4)64)61(10,74)36-17-21-59(8)30-13-14-35-57(5,6)37(18-19-58(35,7)29(30)16-20-60(36,59)9)85-55-50(42(69)34(25-80-55)90-91(75,76)77)89-56-51(88-52-43(70)39(66)31(65)24-79-52)44(71)47(27(3)81-56)86-54-46(73)49(41(68)33(23-63)84-54)87-53-45(72)48(78-11)40(67)32(22-62)83-53;/h12,16,27,30-56,62-63,65-74H,13-15,17-25H2,1-11H3,(H,75,76,77);/q;+1/p-1/t27-,30?,31-,32+,33+,34-,35?,36?,37+,38+,39+,40+,41+,42+,43-,44+,45+,46+,47-,48-,49-,50-,51-,52+,53-,54-,55+,56+,58-,59+,60-,61-;/m1./s1
InChIKey ZYNFXDHCFLAFAO-RESCDVJNSA-M
Mol Weight 1351.5 g/mol
Molecular Formula C61H99NaO29S
Exact Mass 1350.589045 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10EhwGNrS01
Name FRONDOSIDE_A2-7;3-O-{3-O-METHYL-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-(1->4)-[BETA-D-XYLOPYRANOSYL-(1->2)]-BETA-D-QUINOVOPYRANOSYL-(1-
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C61H99NaO29S
InChI InChI=1S/C61H100O29S.Na/c1-26(2)12-15-38(82-28(4)64)61(10,74)36-17-21-59(8)30-13-14-35-57(5,6)37(18-19-58(35,7)29(30)16-20-60(36,59)9)85-55-50(42(69)34(25-80-55)90-91(75,76)77)89-56-51(88-52-43(70)39(66)31(65)24-79-52)44(71)47(27(3)81-56)86-54-46(73)49(41(68)33(23-63)84-54)87-53-45(72)48(78-11)40(67)32(22-62)83-53;/h12,16,27,30-56,62-63,65-74H,13-15,17-25H2,1-11H3,(H,75,76,77);/q;+1/p-1/t27-,30?,31-,32+,33+,34-,35?,36?,37+,38+,39+,40+,41+,42+,43-,44+,45+,46+,47-,48-,49-,50-,51-,52+,53-,54-,55+,56+,58-,59+,60-,61-;/m1./s1
InChIKey ZYNFXDHCFLAFAO-RESCDVJNSA-M
Literature Reference Author A.S.SILCHENKO,S.A.AVILOV,A.S.ANTONOV,A.I.KALINOVSKY,P.S.DMIT RENOK,V.I.KALININ,C.
Literature Reference Citation CAN.J.CHEM.,83,2120(2005)
Literature Reference DOI 10.1139/v05-243
Molecular Weight 1351.489 g/mol
Solvent C5D5N
Source File Reference UWMZ18937
SpectraBase Batch ID 5iAbh9UUdzO