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sodium [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(Z)-2-(4-hydroxyphenyl)ethenyl]phenoxy]oxan-2-yl]methyl sulfate

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sodium [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(Z)-2-(4-hydroxyphenyl)ethenyl]phenoxy]oxan-2-yl]methyl sulfate
SpectraBase Compound ID FWqe7rwkS2E
InChI InChI=1S/C20H22O11S.Na/c21-13-5-3-11(4-6-13)1-2-12-7-14(22)9-15(8-12)30-20-19(25)18(24)17(23)16(31-20)10-29-32(26,27)28;/h1-9,16-25H,10H2,(H,26,27,28);/q;+1/p-1/b2-1-;/t16-,17-,18+,19-,20-;/m1./s1
InChIKey FHFHSKMONLQSAY-DQYPSGOSSA-M
Mol Weight 492.43 g/mol
Molecular Formula C20H21NaO11S
Exact Mass 492.070227 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3PPvBV5VfBb
Name sodium [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(Z)-2-(4-hydroxyphenyl)ethenyl]phenoxy]oxan-2-yl]methyl sulfate
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21NaO11S
InChI InChI=1S/C20H22O11S.Na/c21-13-5-3-11(4-6-13)1-2-12-7-14(22)9-15(8-12)30-20-19(25)18(24)17(23)16(31-20)10-29-32(26,27)28;/h1-9,16-25H,10H2,(H,26,27,28);/q;+1/p-1/b2-1-;/t16-,17-,18+,19-,20-;/m1./s1
InChIKey FHFHSKMONLQSAY-DQYPSGOSSA-M
Literature Reference Author K.XIAO,L.XUAN,Y.XU,D.BAI
Literature Reference Citation J.NAT.PROD.,63,1373(2000)
Literature Reference DOI 10.1021/np000086+
Molecular Weight 492.430 g/mol
Solvent D2O