(Q105274512)

English

3-hydroxy-4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy-4-oxobutanoic acid

group of stereoisomers with the chemical formula C₁₅H₁₆O₉

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

340.079432092 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₅H₁₆O₉

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canonical SMILES

O=C(OC(=O)C(O)CC(=O)O)C=CC1=CC(OC)=C(O)C(OC)=C1

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isomeric SMILES

COc1cc(/C=C/C(=O)OC(=O)C(O)CC(=O)O)cc(OC)c1O

1 reference

1 reference

AtMetExpress development: a phytochemical atlas of Arabidopsis development

Identifiers

InChI

InChI=1S/C15H16O9/c1-22-10-5-8(6-11(23-2)14(10)20)3-4-13(19)24-15(21)9(16)7-12(17)18/h3-6,9,16,20H,7H2,1-2H3,(H,17,18)/b4-3+

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InChIKey

UKFVKXGKUQLPDS-ONEGZZNKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UKFVKXGKUQLPDS-ONEGZZNKSA-N

1 reference

(Q105274512)

3-hydroxy-4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy-4-oxobutanoic acid

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Identifiers

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