John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=I2jMYpnY2zc SpectraBase Spectrum ID=IddioQYPnx

(accessed ).
6-(1-PARA-HYDROXYPHENYL-TRANS-PROPENYL)-CATECHIN-7-O-BETA-D-GLUCOPYRANOSIDE;SACHALISIDE-2
SpectraBase Compound ID I2jMYpnY2zc
InChI InChI=1S/C30H32O12/c31-13-24-26(37)27(38)28(39)30(42-24)41-22-12-23-18(11-21(35)29(40-23)15-6-9-19(33)20(34)10-15)25(36)17(22)3-1-2-14-4-7-16(32)8-5-14/h1-2,4-10,12,21,24,26-39H,3,11,13H2/b2-1+/t21?,24-,26-,27+,28-,29?,30-/m0/s1
InChIKey DUZQFCJYWSXVJS-IFBBNFNLSA-N
Mol Weight 584.6 g/mol
Molecular Formula C30H32O12
Exact Mass 584.189377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IddioQYPnx
Name 6-(1-PARA-HYDROXYPHENYL-TRANS-PROPENYL)-CATECHIN-7-O-BETA-D-GLUCOPYRANOSIDE;SACHALISIDE-2
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H32O12
InChI InChI=1S/C30H32O12/c31-13-24-26(37)27(38)28(39)30(42-24)41-22-12-23-18(11-21(35)29(40-23)15-6-9-19(33)20(34)10-15)25(36)17(22)3-1-2-14-4-7-16(32)8-5-14/h1-2,4-10,12,21,24,26-39H,3,11,13H2/b2-1+/t21?,24-,26-,27+,28-,29?,30-/m0/s1
InChIKey DUZQFCJYWSXVJS-IFBBNFNLSA-N
Literature Reference Author M.MIZUNO,M.KATO,N.HOSOI,M.IINUMA,T.TANAKA
Literature Reference Citation HETEROCYCLES,31,1409(1990)
Literature Reference DOI 10.3987/COM-90-5425
Molecular Weight 584.577 g/mol
Solvent DMSO-D6
Source File Reference UWCP4517
SpectraBase Batch ID 8luAjhBORYI