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GARDENOSIDE;(1S,4AS,7S,7AS)-1-(BETA-D-GLUCOPYRANOSYLOXY)-1,4A,7,7A-TETRAHYDRO-7-HYDROXY-7-(HYDROXYMETHYL)-CYClOPENTA-[C]-PYRAN-4-CARBOXYLIC-ACID
SpectraBase Compound ID K1Q39Q1CwzN
InChI InChI=1S/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10-,11-,12+,13-,15+,16+,17-/m1/s1
InChIKey XJMPAUZQVRGFRE-AYDWLWLASA-N
Mol Weight 404.37 g/mol
Molecular Formula C17H24O11
Exact Mass 404.131862 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3U7f2hwdaW
Name GARDENOSIDE;(1S,4AS,7S,7AS)-1-(BETA-D-GLUCOPYRANOSYLOXY)-1,4A,7,7A-TETRAHYDRO-7-HYDROXY-7-(HYDROXYMETHYL)-CYClOPENTA-[C]-PYRAN-4-CARBOXYLIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H24O11
InChI InChI=1S/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10-,11-,12+,13-,15+,16+,17-/m1/s1
InChIKey XJMPAUZQVRGFRE-AYDWLWLASA-N
Literature Reference Author H.A.R.FARID,O.KUNERT,E.HASLINGER,C.SEGER
Literature Reference Citation MH.CHEM.,133,1453(2002)
Literature Reference DOI 10.1007/s00706-002-0500-0
Molecular Weight 404.371 g/mol
Solvent CD3OD
Source File Reference UWKP4090