(Q105022202)

English

3-[2-(4-Hydroxy-3-methoxyphenyl)-2,3-dihydro-3-(hydroxymethyl)-7-methoxybenzofuran-5-yl]propenal

group of stereoisomers with the chemical formula C₂₀H₂₀O₆

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Statements

group of stereoisomers

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biogenic benzofuran

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biogenic benzofuran

356.12598836 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₀O₆

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canonical SMILES

O=CC=CC=1C=C(OC)C=2OC(C3=CC=C(O)C(OC)=C3)C(C2C1)CO

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isomeric SMILES

COc1cc(C2Oc3c(OC)cc(/C=C/C=O)cc3C2CO)ccc1O

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+

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GWCSSLSMGCFIFR-ONEGZZNKSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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