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CHEBI:60306 - 8-hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylate

ChEBI IDCHEBI:60306
ChEBI Name8-hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylate
Stars
DefinitionTransition state of the chorismate mutase catalyzed Claisen rearrangement of chorismate to prephenate.
Last Modified30 September 2010
Submitterrsolimeo
DownloadsMolfile
FormulaC10H10O6
Net Charge-2
Average Mass226.184
Monoisotopic Mass226.04884
SMILESO=C([O-])C1CC2(C(=O)[O-])C=CC(O)C(C2)O1
InChIInChI=1S/C10H12O6/c11-5-1-2-10(9(14)15)3-6(5)16-7(4-10)8(12)13/h1-2,5-7,11H,3-4H2,(H,12,13)(H,14,15)/p-2
InChIKeyKRZHNRULRHECRF-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
8-hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylate (CHEBI:60306) is a dicarboxylic acid anion (CHEBI:35693)
8-hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylate (CHEBI:60306) is conjugate base of 8-hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylic acid (CHEBI:60328)
Incoming Relation(s)
8-hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylic acid (CHEBI:60328) is conjugate acid of 8-hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylate (CHEBI:60306)
IUPAC Name 
8-hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylate
Synonyms  Source
endo-oxabicyclicSUBMITTER
endo-oxabicyclic dicarboxylateChEBI
Citations