CHEBI:60129 - (1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate
ChEBI ID CHEBI:60129
ChEBI ASCII Name (1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate
Definition The (1R,6S)-enantiomer of cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylate.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C7H7O4
Net Charge -1
Average Mass 155.12810
Monoisotopic Mass 155.03498
InChI InChI=1S/C7H8O4/c8-5-3-1-2-4-7(5,11)6(9)10/h1-5,8,11H,(H,9,10)/p-1/t5-,7+/m0/s1
InChIKey PUCYIVFXTPWJDD-CAHLUQPWSA-M
SMILES O[C@H]1C=CC=C[C@]1(O)C([O-])=O
ChEBI Ontology
Outgoing (1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:60129) is a cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylate (CHEBI:36465)
(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:60129) is conjugate base of (1R,6S)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid (CHEBI:37888)
(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:60129) is enantiomer of (1S,6R)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:60131)
Incoming (1R,6S)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid (CHEBI:37888) is conjugate acid of (1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:60129)
(1S,6R)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:60131) is enantiomer of (1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate (CHEBI:60129)
IUPAC Name
(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate
Synonyms Sources
(1R,2S)-1,2-dihydroxycyclohexa-3,5-diene-1-carboxylate ChEBI
(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate UniProt
Last Modified
17 September 2010