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CHEBI:79200 - (R)-dihydrocamalexate

ChEBI IDCHEBI:79200
ChEBI Name(R)-dihydrocamalexate
Stars
ASCII Name(R)-dihydrocamalexate
DefinitionA monocarboxylic acid anion that is the conjugate base of (R)-dihydrocamalexic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified19 September 2014
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC12H9N2O2S
Net Charge-1
Average Mass245.283
Monoisotopic Mass245.03902
SMILES[H]n1cc(C2=N[C@H](C(=O)[O-])CS2)c2ccccc21
InChIInChI=1S/C12H10N2O2S/c15-12(16)10-6-17-11(14-10)8-5-13-9-4-2-1-3-7(8)9/h1-5,10,13H,6H2,(H,15,16)/p-1/t10-/m0/s1
InChIKeyGTTVJFCVXYCPHB-JTQLQIEISA-M
ChEBI Ontology
Outgoing Relation(s)
(R)-dihydrocamalexate (CHEBI:79200) is a monocarboxylic acid anion (CHEBI:35757)
(R)-dihydrocamalexate (CHEBI:79200) is conjugate base of (R)-dihydrocamalexic acid (CHEBI:47795)
(R)-dihydrocamalexate (CHEBI:79200) is enantiomer of (S)-dihydrocamalexate (CHEBI:71048)
Incoming Relation(s)
(R)-dihydrocamalexic acid (CHEBI:47795) is conjugate acid of (R)-dihydrocamalexate (CHEBI:79200)
(S)-dihydrocamalexate (CHEBI:71048) is enantiomer of (R)-dihydrocamalexate (CHEBI:79200)
IUPAC Name 
(4R)-2-(1H-indol-3-yl)-4,5-dihydro-1,3-thiazole-4-carboxylate
UniProt Name  Source
(R)-dihydrocamalexateUniProt
Citations