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Concept information

Preferred term

سیناپویل (S) مالات (2)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • -2

formula

  • C15H14O9

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

mass

  • 338.26630

monoisotopicmass

  • 338.06488

smiles

  • COc1cc(cc(OC)c1OC(=O)[C@@H](O)CC([O-])=O)/C=C/C([O-])=O

subset

  • 3_STAR

synonym EXACT

  • (3S)-4-{4-[(E)-2-carboxylatoethenyl]-2,6-dimethoxyphenoxy}-3-hydroxy-4-oxobutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:57426

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