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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > malate ester > sinapic acid (s)-malate ester
organooxygen compound > carbonyl compound > carboxylic ester > malate ester > sinapic acid (s)-malate ester

Preferred term

sinapic acid (s)-malate ester  

Type

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

Broader concept

alt_id

  • CHEBI:15086
  • CHEBI:26685
  • CHEBI:9154

charge

  • 0

formula

  • C15H16O9

has_functional_parent

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)/b4-3+/t9-/m0/s1

inchikey

  • SVOZVFTXNDIEBH-NWALNABHSA-N

is_conjugate_acid_of

mass

  • 340.28214

monoisotopicmass

  • 340.07943

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 3-(4-{[(2S)-3-carboxy-2-hydroxypropanoyl]oxy}-3,5-dimethoxyphenyl)prop-2-enoic acid

synonym RELATED

  • Sinapoyl-(S)-malate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:15596

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