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CHEBI:58689 - (1R,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate

ChEBI IDCHEBI:58689
ChEBI Name(1R,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate
Stars
ASCII Name(1R,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate
DefinitionDicarboxylate anion of (1R,6R)-2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid.
Last Modified23 July 2014
DownloadsMolfile
FormulaC11H10O6
Net Charge-2
Average Mass238.195
Monoisotopic Mass238.04884
SMILESO=C([O-])CCC(=O)C1=CC=C[C@@H](O)[C@@H]1C(=O)[O-]
InChIInChI=1S/C11H12O6/c12-7(4-5-9(14)15)6-2-1-3-8(13)10(6)11(16)17/h1-3,8,10,13H,4-5H2,(H,14,15)(H,16,17)/p-2/t8-,10-/m1/s1
InChIKeyQJYRAJSESKVEAE-PSASIEDQSA-L
ChEBI Ontology
Outgoing Relation(s)
(1R,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:58689) is a dicarboxylic acid dianion (CHEBI:28965)
(1R,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:58689) is conjugate base of (1R,6R)-2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid (CHEBI:39564)
Incoming Relation(s)
(1R,6R)-2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid (CHEBI:39564) is conjugate acid of (1R,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:58689)
IUPAC Name 
(1R,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate
UniProt Name  Source
(1R,6R)-6-hydroxy-2-succinyl-cyclohexa-2,4-diene-1-carboxylateUniProt