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5,4'-O-BETA-D-DIGLUCOPYRANOSYL-CIRSIMARITIN

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5,4'-O-BETA-D-DIGLUCOPYRANOSYL-CIRSIMARITIN
SpectraBase Compound ID 1SAX5HAHh8C
InChI InChI=1S/C29H34O16/c1-39-16-8-15-19(27(26(16)40-2)45-29-25(38)23(36)21(34)18(10-31)44-29)13(32)7-14(42-15)11-3-5-12(6-4-11)41-28-24(37)22(35)20(33)17(9-30)43-28/h3-8,17-18,20-25,28-31,33-38H,9-10H2,1-2H3/t17-,18-,20-,21-,22+,23+,24-,25-,28-,29+/m0/s1
InChIKey VVQCEDHDCLBRTM-VNZFUCCLSA-N
Mol Weight 638.6 g/mol
Molecular Formula C29H34O16
Exact Mass 638.184685 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 489WaZeYrcr
Name 5,4'-O-BETA-D-DIGLUCOPYRANOSYL-CIRSIMARITIN
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H34O16
InChI InChI=1S/C29H34O16/c1-39-16-8-15-19(27(26(16)40-2)45-29-25(38)23(36)21(34)18(10-31)44-29)13(32)7-14(42-15)11-3-5-12(6-4-11)41-28-24(37)22(35)20(33)17(9-30)43-28/h3-8,17-18,20-25,28-31,33-38H,9-10H2,1-2H3/t17-,18-,20-,21-,22+,23+,24-,25-,28-,29+/m0/s1
InChIKey VVQCEDHDCLBRTM-VNZFUCCLSA-N
Literature Reference Author N.BAI,K.HE,M.ROLLER,C.S.LAI,X.SHAO,M.H.PAN,A.BILY,C.T.HO
Literature Reference Citation FITOTERAPIA,82,168(2011)
Literature Reference DOI 10.1016/j.fitote.2010.08.014
Molecular Weight 638.579 g/mol
Solvent DMSO-D6
Source File Reference UWDB1178