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3'-DEOXYISOZYGOLONE_A;8-HYDROXY-3-(4'-HYDROXYPHENYL)-(2''-PROPENYL-2'',3''-DIHYDROFURAN)-[4''.5'':6.7]-TETRALONE
SpectraBase Compound ID 4ewEHDUZ2j5
InChI InChI=1S/C21H20O4/c1-11(2)18-10-16-19(25-18)9-14-7-13(8-17(23)20(14)21(16)24)12-3-5-15(22)6-4-12/h3-6,9,13,18,22,24H,1,7-8,10H2,2H3/t13-,18?/m1/s1
InChIKey ABNQAOSEMURKBZ-YJJYDOSJSA-N
Mol Weight 336.39 g/mol
Molecular Formula C21H20O4
Exact Mass 336.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Xc6wCnNWFu
Name 3'-DEOXYISOZYGOLONE_A;8-HYDROXY-3-(4'-HYDROXYPHENYL)-(2''-PROPENYL-2'',3''-DIHYDROFURAN)-[4''.5'':6.7]-TETRALONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20O4
InChI InChI=1S/C21H20O4/c1-11(2)18-10-16-19(25-18)9-14-7-13(8-17(23)20(14)21(16)24)12-3-5-15(22)6-4-12/h3-6,9,13,18,22,24H,1,7-8,10H2,2H3/t13-,18?/m1/s1
InChIKey ABNQAOSEMURKBZ-YJJYDOSJSA-N
Literature Reference Author K.P.DEVKOTA,D.COVELL,T.RANSOM,J.B.MCMAHO,J.A.BEUTLER
Literature Reference Citation J.NAT.PROD.,76,710(2013)
Literature Reference DOI 10.1021/np400042q
Molecular Weight 336.387 g/mol
Sample ID 42432
Solvent CDCl3