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ALPHA-ALECTORONIC-ACID
SpectraBase Compound ID 59JJkbnIMtB
InChI InChI=1S/C28H32O9/c1-3-5-7-9-17(29)11-16-12-18(30)13-21-23(16)26(32)36-22-14-20(31)24-19(25(22)35-21)15-28(34,37-27(24)33)10-8-6-4-2/h12-14,30-31,34H,3-11,15H2,1-2H3
InChIKey WXVYEDQSVKIIFW-UHFFFAOYSA-N
Mol Weight 512.6 g/mol
Molecular Formula C28H32O9
Exact Mass 512.204633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F832dAoqeKw
Name ALPHA-ALECTORONIC_ACID
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H32O9
InChI InChI=1S/C28H32O9/c1-3-5-7-9-17(29)11-16-12-18(30)13-21-23(16)26(32)36-22-14-20(31)24-19(25(22)35-21)15-28(34,37-27(24)33)10-8-6-4-2/h12-14,30-31,34H,3-11,15H2,1-2H3
InChIKey WXVYEDQSVKIIFW-UHFFFAOYSA-N
Literature Reference Author M.MILLOT,S.TOMASI,K.ARTICUS,I.ROUAUD,A.BERNARD,J.BOUSTIE
Literature Reference Citation J.NAT.PROD.,70,316(2007)
Literature Reference DOI 10.1021/np060561p
Molecular Weight 512.557 g/mol
Sample ID 29708
Solvent ACETONE-D6