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PHELLIGRIDIN_D;3-(3,4-DIHYDROXYSTYRYL)-8,9-DIHYDROPYRANO-[4.3-C]-ISOCHROMENE-4-ONE
SpectraBase Compound ID IjkPPKKg4fb
InChI InChI=1S/C20H12O8/c21-13-4-2-9(5-14(13)22)1-3-10-6-17-18(20(26)27-10)11-7-15(23)16(24)8-12(11)19(25)28-17/h1-8,21-24H/b3-1+
InChIKey KKEIHFGUYDHUBS-HNQUOIGGSA-N
Mol Weight 380.31 g/mol
Molecular Formula C20H12O8
Exact Mass 380.053217 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ZzwYWMjHCm
Name PHELLIGRIDIN_D;3-(3,4-DIHYDROXYSTYRYL)-8,9-DIHYDROPYRANO-[4.3-C]-ISOCHROMENE-4-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H12O8
InChI InChI=1S/C20H12O8/c21-13-4-2-9(5-14(13)22)1-3-10-6-17-18(20(26)27-10)11-7-15(23)16(24)8-12(11)19(25)28-17/h1-8,21-24H/b3-1+
InChIKey KKEIHFGUYDHUBS-HNQUOIGGSA-N
Literature Reference Author S.MO,S.WANG,G.ZHOU,Y.YANG,Y.LI,X.CHEN,J.SHI
Literature Reference Citation J.NAT.PROD.,67,823(2004)
Literature Reference DOI 10.1021/np030505d
Molecular Weight 380.310 g/mol
Solvent DMSO-D6
Source File Reference UWMZ5782