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ROSSICASIN-A;TRANS-PARA-COUMARYL-(6'-O-BETA-D-XYLOPYRANOSYL)-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 4MWy9B5LNmb
InChI InChI=1S/C20H28O11/c21-11-5-3-10(4-6-11)2-1-7-28-20-18(27)16(25)15(24)13(31-20)9-30-19-17(26)14(23)12(22)8-29-19/h1-6,12-27H,7-9H2/b2-1+/t12-,13+,14+,15+,16-,17-,18+,19+,20+/m0/s1
InChIKey YCTDNVHNLSTJIK-JHAOMHPTSA-N
Mol Weight 444.43 g/mol
Molecular Formula C20H28O11
Exact Mass 444.163162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7sH7XHsgM4O
Name ROSSICASIN-A;TRANS-PARA-COUMARYL-(6'-O-BETA-D-XYLOPYRANOSYL)-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O11
InChI InChI=1S/C20H28O11/c21-11-5-3-10(4-6-11)2-1-7-28-20-18(27)16(25)15(24)13(31-20)9-30-19-17(26)14(23)12(22)8-29-19/h1-6,12-27H,7-9H2/b2-1+/t12-,13+,14+,15+,16-,17-,18+,19+,20+/m0/s1
InChIKey YCTDNVHNLSTJIK-JHAOMHPTSA-N
Literature Reference Author M.H.SHYR,T.H.TSAI,L.C.LIN
Literature Reference Citation CHEM.PHARM.BULL.,54,252(2006)
Literature Reference DOI 10.1248/cpb.54.252
Molecular Weight 444.436 g/mol
Sample ID 37114
Solvent CD3OD