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(Z)- 4-[.beta.-(3,4-Dihydroxyphenyl)ethenyl]-2-(3',5'-dihydroxyphenyl)-3-(3",4"-dihydroxyphenyl)-6-hydroxy-2,3-dihydrobenzofuran
SpectraBase Compound ID CdpZcrxcevR
InChI InChI=1S/C28H22O8/c29-18-9-17(10-19(30)12-18)27-26-15(3-1-14-2-5-21(32)23(34)7-14)8-20(31)13-25(26)36-28(27)16-4-6-22(33)24(35)11-16/h1-13,27-35H/b3-1-
InChIKey MTYSFTYBAMMIGE-IWQZZHSRSA-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 AOFY4kyNvNa
Name (Z)- 4-[.beta.-(3,4-Dihydroxyphenyl)ethenyl]-2-(3',5'-dihydroxyphenyl)-3-(3",4"-dihydroxyphenyl)-6-hydroxy-2,3-dihydrobenzofuran
Comments Less than 3 mono-isotopic peaks
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Formula C28H22O8
InChI InChI=1S/C28H22O8/c29-18-9-17(10-19(30)12-18)27-26-15(3-1-14-2-5-21(32)23(34)7-14)8-20(31)13-25(26)36-28(27)16-4-6-22(33)24(35)11-16/h1-13,27-35H/b3-1-
InChIKey MTYSFTYBAMMIGE-IWQZZHSRSA-N
Molecular Weight 486.476 g/mol
SMILES Oc1cc(\C=C/c2cc(cc3OC(C(c4cc(cc(c4)O)O)c23)c2cc(O)c(cc2)O)O)ccc1O
SPLASH splash10-000f-0490000000-d2e3aa96b4648db01398
Source of Spectrum X3-35-579-3
Synonyms Scirpusin b-cis
Wiley ID 1713674