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CHEBI:57413 - (1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate

ChEBI IDCHEBI:57413
ChEBI Name(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate
Stars
ASCII Name(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate
DefinitionConjugate base of (1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid.
Last Modified13 November 2017
DownloadsMolfile
FormulaC7H11O4
Net Charge-1
Average Mass159.161
Monoisotopic Mass159.06628
SMILESO=C([O-])[C@H]1CC[C@H](O)[C@H](O)C1
InChIInChI=1S/C7H12O4/c8-5-2-1-4(7(10)11)3-6(5)9/h4-6,8-9H,1-3H2,(H,10,11)/p-1/t4-,5-,6+/m0/s1
InChIKeyPTPROPUVXIZJPL-HCWXCVPCSA-M
ChEBI Ontology
Outgoing Relation(s)
(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate (CHEBI:57413) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate (CHEBI:57413) is conjugate base of (1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid (CHEBI:15566)
Incoming Relation(s)
(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid (CHEBI:15566) is conjugate acid of (1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate (CHEBI:57413)
IUPAC Name 
(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate
UniProt Name  Source
(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylateUniProt