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CHEBI:58420 - cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate

ChEBI IDCHEBI:58420
ChEBI Namecis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate
Stars
ASCII Namecis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate
DefinitionConjugate base of cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylic acid.
Last Modified14 November 2016
DownloadsMolfile
FormulaC10H13O4
Net Charge-1
Average Mass197.210
Monoisotopic Mass197.08193
SMILESCC(C)C1=CC=C(C(=O)[O-])[C@@H](O)[C@H]1O
InChIInChI=1S/C10H14O4/c1-5(2)6-3-4-7(10(13)14)9(12)8(6)11/h3-5,8-9,11-12H,1-2H3,(H,13,14)/p-1/t8-,9+/m0/s1
InChIKeyBUZNWVREDOAOGD-DTWKUNHWSA-M
ChEBI Ontology
Outgoing Relation(s)
cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate (CHEBI:58420) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate (CHEBI:58420) is conjugate base of cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylic acid (CHEBI:18242)
Incoming Relation(s)
cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylic acid (CHEBI:18242) is conjugate acid of cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate (CHEBI:58420)
IUPAC Name 
rel-(5R,6S)-5,6-dihydroxy-4-(propan-2-yl)cyclohexa-1,3-diene-1-carboxylate
UniProt Name  Source
(2R,3S)-2,3-dihydroxy-2,3-dihydro-p-cumateUniProt