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CHEBI:58901 - 2-(E)-O-feruloyl-D-galactarate(2−)

ChEBI IDCHEBI:58901
ChEBI Name2-(E)-O-feruloyl-D-galactarate(2−)
Stars
ASCII Name2-(E)-O-feruloyl-D-galactarate(2-)
DefinitionA dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxy groups of 2-(E)-O-feruloyl-D-galactaric acid.
Last Modified21 May 2021
DownloadsMolfile
FormulaC16H16O11
Net Charge-2
Average Mass384.293
Monoisotopic Mass384.07036
SMILESCOc1cc(/C=C/C(=O)O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H](O)C(=O)[O-])ccc1O
InChIInChI=1S/C16H18O11/c1-26-9-6-7(2-4-8(9)17)3-5-10(18)27-14(16(24)25)12(20)11(19)13(21)15(22)23/h2-6,11-14,17,19-21H,1H3,(H,22,23)(H,24,25)/p-2/b5-3+/t11-,12+,13+,14-/m1/s1
InChIKeyJZRAOXRUPYISEN-MOEPPVLCSA-L
ChEBI Ontology
Outgoing Relation(s)
2-(E)-O-feruloyl-D-galactarate(2−) (CHEBI:58901) is a carbohydrate acid derivative anion (CHEBI:63551)
2-(E)-O-feruloyl-D-galactarate(2−) (CHEBI:58901) is a dicarboxylic acid dianion (CHEBI:28965)
2-(E)-O-feruloyl-D-galactarate(2−) (CHEBI:58901) is conjugate base of 2-(E)-O-feruloyl-D-galactaric acid (CHEBI:52785)
Incoming Relation(s)
2-(E)-O-feruloyl-D-galactaric acid (CHEBI:52785) is conjugate acid of 2-(E)-O-feruloyl-D-galactarate(2−) (CHEBI:58901)
IUPAC Name 
2-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-D-galactarate
UniProt Name  Source
2-O-[(E)-feruloyl]-D-galactarateUniProt