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CHEBI:58768 - (1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate

ChEBI IDCHEBI:58768
ChEBI Name(1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate
Stars
ASCII Name(1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate
DefinitionConjugate base of (1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylic acid.
Last Modified19 October 2017
DownloadsMolfile
FormulaC8H9O4
Net Charge-1
Average Mass169.156
Monoisotopic Mass169.05063
SMILESCC1=C[C@H](O)[C@@](O)(C(=O)[O-])C=C1
InChIInChI=1S/C8H10O4/c1-5-2-3-8(12,7(10)11)6(9)4-5/h2-4,6,9,12H,1H3,(H,10,11)/p-1/t6-,8+/m0/s1
InChIKeyKWQSYZVAOWYCNP-POYBYMJQSA-M
ChEBI Ontology
Outgoing Relation(s)
(1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate (CHEBI:58768) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
(1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate (CHEBI:58768) is conjugate base of (1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylic acid (CHEBI:49008)
Incoming Relation(s)
(1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylic acid (CHEBI:49008) is conjugate acid of (1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate (CHEBI:58768)
IUPAC Name 
(1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate
UniProt Name  Source
(1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylateUniProt