(Q105350161)

English

3,4-Dihydroxy-1-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]-5-[3-(4-hydroxyphenyl)prop-2-enoyloxy]cyclohexane-1-carboxylic acid

group of stereoisomers with the chemical formula C₂₆H₂₆O₁₁

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Statements

group of stereoisomers

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alkyl caffeate ester

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alkyl caffeate ester

514.1475116519997 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₆H₂₆O₁₁

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canonical SMILES

O=C(OC1CC(OC(=O)C=CC2=CC=C(O)C(OC)=C2)(C(=O)O)CC(O)C1O)C=CC3=CC=C(O)C=C3

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Identifiers

InChI=1S/C26H26O11/c1-35-20-12-16(4-9-18(20)28)6-11-23(31)37-26(25(33)34)13-19(29)24(32)21(14-26)36-22(30)10-5-15-2-7-17(27)8-3-15/h2-12,19,21,24,27-29,32H,13-14H2,1H3,(H,33,34)

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YLKBTONOZYPFLU-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

YLKBTONOZYPFLU-UHFFFAOYSA-N

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