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PHELLIGRIDIN_E;8,9-DIHYDROXY-3-{5',6'-DIHYDROXY-5''-METHYL-3''-OXO-SPIRO-[FURAN-2''-(3''-H9,1'-INDENE]-2'-YL}-1-H,6-H-PYRANO-[4.3-C]-[2]-BENZOPYRAN
SpectraBase Compound ID 53XLpEfrb8g
InChI InChI=1S/C25H14O10/c1-9-2-21(30)25(35-9)13-7-18(29)15(26)4-10(13)3-14(25)19-8-20-22(24(32)33-19)11-5-16(27)17(28)6-12(11)23(31)34-20/h2-8,26-29H,1H3
InChIKey DMSAIYCKECUGHO-UHFFFAOYSA-N
Mol Weight 474.38 g/mol
Molecular Formula C25H14O10
Exact Mass 474.058697 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hzs5uOGrIW7
Name PHELLIGRIDIN_E;8,9-DIHYDROXY-3-{5',6'-DIHYDROXY-5''-METHYL-3''-OXO-SPIRO-[FURAN-2''-(3''-H9,1'-INDENE]-2'-YL}-1-H,6-H-PYRANO-[4.3-C]-[2]-BENZOPYRAN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H14O10
InChI InChI=1S/C25H14O10/c1-9-2-21(30)25(35-9)13-7-18(29)15(26)4-10(13)3-14(25)19-8-20-22(24(32)33-19)11-5-16(27)17(28)6-12(11)23(31)34-20/h2-8,26-29H,1H3
InChIKey DMSAIYCKECUGHO-UHFFFAOYSA-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 474.380 g/mol
Solvent DMSO-D6
Source File Reference UWMZ5783