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4'-ACETYL-3'-ISOBUTYRYL-3'-HYDROXYMARMESIN
SpectraBase Compound ID DvJ9dAQCOnL
InChI InChI=1S/C20H22O7/c1-10(2)19(23)26-17-13-8-12-6-7-16(22)24-14(12)9-15(13)25-18(17)20(4,5)27-11(3)21/h6-10,17-18H,1-5H3/t17-,18+/m1/s1
InChIKey IAFDNCWNSBMBIV-MSOLQXFVSA-N
Mol Weight 374.39 g/mol
Molecular Formula C20H22O7
Exact Mass 374.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3WlmflIaLlt
Name 4'-ACETYL-3'-ISOBUTYRYL-3'-HYDROXYMARMESIN
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22O7
InChI InChI=1S/C20H22O7/c1-10(2)19(23)26-17-13-8-12-6-7-16(22)24-14(12)9-15(13)25-18(17)20(4,5)27-11(3)21/h6-10,17-18H,1-5H3/t17-,18+/m1/s1
InChIKey IAFDNCWNSBMBIV-MSOLQXFVSA-N
Literature Reference Author G.APPENDINO,F.BIANCHI,A.BADER,C.CAMPAGNUOLO,E.FATTORUSSO,O.T AGLIALATELA-SCAFATI,
Literature Reference Citation J.NAT.PROD.,67,532(2004)
Literature Reference DOI 10.1021/np0340652
Molecular Weight 374.390 g/mol
Solvent CDCl3
Source File Reference UWMZ7060