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GERANYL_6-O-BETA-D-XYLOPYRANOSYL-BETA-D-GLUCOPYRANOSIDE_HEXAACETATE
SpectraBase Compound ID 6OykHV0FRnr
InChI InChI=1S/C33H48O16/c1-17(2)11-10-12-18(3)13-14-40-33-31(48-24(9)39)29(46-22(7)37)27(44-20(5)35)26(49-33)16-42-32-30(47-23(8)38)28(45-21(6)36)25(15-41-32)43-19(4)34/h11,13,25-33H,10,12,14-16H2,1-9H3/b18-13+/t25-,26+,27+,28+,29-,30-,31+,32+,33+/m1/s1
InChIKey UDSXITLSZFDIIO-GITMBAFCSA-N
Mol Weight 700.7 g/mol
Molecular Formula C33H48O16
Exact Mass 700.294235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVDRO1WCoNa
Name GERANYL_6-O-BETA-D-XYLOPYRANOSYL-BETA-D-GLUCOPYRANOSIDE_HEXAACETATE
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H48O16
InChI InChI=1S/C33H48O16/c1-17(2)11-10-12-18(3)13-14-40-33-31(48-24(9)39)29(46-22(7)37)27(44-20(5)35)26(49-33)16-42-32-30(47-23(8)38)28(45-21(6)36)25(15-41-32)43-19(4)34/h11,13,25-33H,10,12,14-16H2,1-9H3/b18-13+/t25-,26+,27+,28+,29-,30-,31+,32+,33+/m1/s1
InChIKey UDSXITLSZFDIIO-GITMBAFCSA-N
Literature Reference Author W.GUO,K.SAKATA,N.WATANABE,R.NAKAJIMA,A.YAGI,K.INA,S.LUO
Literature Reference Citation PHYTOCHEM.,33,1373(1993)
Literature Reference DOI 10.1016/0031-9422(93)85093-7
Molecular Weight 700.735 g/mol
Solvent CDCl3
Source File Reference UWMZ11726