CHEBI:57426 - sinapoyl (S)-malate(2−)

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ChEBI Name sinapoyl (S)-malate(2−) ChEBI ID CHEBI:57426 ChEBI ASCII Name sinapoyl (S)-malate(2-) Definition Dicarboxylate anion of sinapic acid (S)-malate ester Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C15H14O9 Net Charge -2 Average Mass 338.26630 Monoisotopic Mass 338.06488 InChI InChI=1S/C15H16O9/c1-22-10-5-8(3-4-12(17)18)6-11(23-2)14(10)24-15(21)9(16)7-13(19)20/h3-6,9,16H,7H2,1-2H3,(H,17,18)(H,19,20)/p-2/b4-3+/t9-/m0/s1 InChIKey SVOZVFTXNDIEBH-NWALNABHSA-L SMILES COc1cc(cc(OC)c1OC(=O)[C@@H](O)CC([O-])=O)\C=C\C([O-])=O ChEBI Ontology Outgoing sinapoyl (S)-malate(2−) (CHEBI:57426) is a dicarboxylic acid dianion (CHEBI:28965) sinapoyl (S)-malate(2−) (CHEBI:57426) is conjugate base of sinapic acid (S)-malate ester (CHEBI:15596) Incoming sinapic acid (S)-malate ester (CHEBI:15596) is conjugate acid of sinapoyl (S)-malate(2−) (CHEBI:57426) IUPAC Name (3S)-4-{4-[(E)-2-carboxylatoethenyl]-2,6-dimethoxyphenoxy}-3-hydroxy-4-oxobutanoate Synonyms Sources (3S)-4-{4-[(E)-2-carboxylatovinyl]-2,6-dimethoxyphenoxy}-3-hydroxy-4-oxobutanoate ChEBI 3-(4-{[(2S)-3-carboxy-2-hydroxypropanoyl]oxy}-3,5-dimethoxyphenyl)acrylate ChEBI 3-(4-{[(2S)-3-carboxy-2-hydroxypropanoyl]oxy}-3,5-dimethoxyphenyl)prop-2-enoate ChEBI sinapoyl (S)-malate UniProt Last Modified 31 July 2015