(Q104918294)

English

3-(3,4-dihydroxy-5-methoxyphenyl)propyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

chemical compound

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No label defined

No description defined

Statements

type of chemical entity

0 references

alkyl caffeate ester

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374.136553044 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₂O₇

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canonical SMILES

O=C(OCCCC1=CC(O)=C(O)C(OC)=C1)C=CC2=CC=C(O)C(OC)=C2

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isomeric SMILES

COc1cc(/C=C/C(=O)OCCCc2cc(O)c(O)c(OC)c2)ccc1O

1 reference

based on heuristic

inferred from InChI

Oedera fruticosa

1 reference

Diterpenes and other constituents fromRelhania species

Relhania fruticosa

1 reference

Diterpenes and other constituents fromRelhania species

Identifiers

InChI=1S/C20H22O7/c1-25-17-11-13(5-7-15(17)21)6-8-19(23)27-9-3-4-14-10-16(22)20(24)18(12-14)26-2/h5-8,10-12,21-22,24H,3-4,9H2,1-2H3/b8-6+

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ATCFJKWWRHDBNY-SOFGYWHQSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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