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(E)- 5-[.beta.-(3,5-Dihydroxyphenyl)ethenyl]-2-(3',5'-dihydroxyphenyl)-3-(3",4"-dihydroxyphenyl)-7-hydroxy-2,3-dihydrobenzofuran
SpectraBase Compound ID 4cLjQ5NNFJu
InChI InChI=1S/C28H22O8/c29-18-5-14(6-19(30)12-18)1-2-15-7-22-26(17-9-20(31)13-21(32)10-17)27(36-28(22)25(35)8-15)16-3-4-23(33)24(34)11-16/h1-13,26-27,29-35H/b2-1+
InChIKey VDAWNINGWMJAEA-OWOJBTEDSA-N
Mol Weight 486.48 g/mol
Molecular Formula C28H22O8
Exact Mass 486.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSNoYaHXV1u
Name (E)- 5-[.beta.-(3,5-Dihydroxyphenyl)ethenyl]-2-(3',5'-dihydroxyphenyl)-3-(3",4"-dihydroxyphenyl)-7-hydroxy-2,3-dihydrobenzofuran
Alternate Name(s) Maackin A
Comments Less than 3 mono-isotopic peaks
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Formula C28H22O8
InChI InChI=1S/C28H22O8/c29-18-5-14(6-19(30)12-18)1-2-15-7-22-26(17-9-20(31)13-21(32)10-17)27(36-28(22)25(35)8-15)16-3-4-23(33)24(34)11-16/h1-13,26-27,29-35H/b2-1+
InChIKey VDAWNINGWMJAEA-OWOJBTEDSA-N
Molecular Weight 486.476 g/mol
SMILES Oc1cc(\C=C\c2cc3C(c4cc(cc(c4)O)O)C(Oc3c(c2)O)c2cc(O)c(cc2)O)cc(c1)O
SPLASH splash10-0006-0290000000-b0140e515a684738feaf
Source of Spectrum X3-35-578-1
Wiley ID 1691755