John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=26zrIcHowDW SpectraBase Spectrum ID=1kWOVv9gNPq

(accessed ).
KAEMPFEROL_7-O-(6-TRANS-CAFFEOYL)-BETA-GLUCOPYRANOSYL-(1->2)-ALPHA-RHAMOPYRANOSIDE;CHIIRICANIN
SpectraBase Compound ID 26zrIcHowDW
InChI InChI=1S/C36H36O18/c1-14-26(42)30(46)34(54-35-32(48)29(45)27(43)23(53-35)13-49-24(41)9-3-15-2-8-19(38)20(39)10-15)36(50-14)51-18-11-21(40)25-22(12-18)52-33(31(47)28(25)44)16-4-6-17(37)7-5-16/h2-12,14,23,26-27,29-30,32,34-40,42-43,45-48H,13H2,1H3/b9-3+/t14-,23+,26-,27+,29-,30+,32+,34+,35?,36-/m0/s1
InChIKey JBSWLJUKDNZWDG-CYOCANJXSA-N
Mol Weight 756.7 g/mol
Molecular Formula C36H36O18
Exact Mass 756.190165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1kWOVv9gNPq
Name KAEMPFEROL_7-O-(6-TRANS-CAFFEOYL)-BETA-GLUCOPYRANOSYL-(1->2)-ALPHA-RHAMOPYRANOSIDE;CHIIRICANIN
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H36O18
InChI InChI=1S/C36H36O18/c1-14-26(42)30(46)34(54-35-32(48)29(45)27(43)23(53-35)13-49-24(41)9-3-15-2-8-19(38)20(39)10-15)36(50-14)51-18-11-21(40)25-22(12-18)52-33(31(47)28(25)44)16-4-6-17(37)7-5-16/h2-12,14,23,26-27,29-30,32,34-40,42-43,45-48H,13H2,1H3/b9-3+/t14-,23+,26-,27+,29-,30+,32+,34+,35?,36-/m0/s1
InChIKey JBSWLJUKDNZWDG-CYOCANJXSA-N
Literature Reference Author H.J.JEONG,W.K.WHANG,I.H.KIM
Literature Reference Citation PLANTA.MED.,63,329(1997)
Literature Reference DOI 10.1055/s-2006-957694
Molecular Weight 756.671 g/mol
Solvent DMSO-D6
Source File Reference UIAP956
SpectraBase Batch ID 5gbv6n7SqHi