(Q104169069)

English

(4-Hydroxy-2-methylbutyl) 3-(3,4-dihydroxyphenyl)prop-2-enoate

group of stereoisomers with the chemical formula C₁₄H₁₈O₅

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Statements

group of stereoisomers

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alkyl caffeate ester

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alkyl caffeate ester

266.115423676 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₄H₁₈O₅

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canonical SMILES

O=C(OCC(C)CCO)C=CC1=CC=C(O)C(O)=C1

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Identifiers

InChI=1S/C14H18O5/c1-10(6-7-15)9-19-14(18)5-3-11-2-4-12(16)13(17)8-11/h2-5,8,10,15-17H,6-7,9H2,1H3

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ISCFZGDGRGXVNJ-UHFFFAOYSA-N

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2 references

4 January 2023

based on heuristic

inferred from InChIKey

matched by identifier from

ISCFZGDGRGXVNJ-UHFFFAOYSA-N

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