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CHEBI:47796 - (S)-dihydrocamalexic acid

ChEBI IDCHEBI:47796
ChEBI Name(S)-dihydrocamalexic acid
Stars
ASCII Name(S)-dihydrocamalexic acid
Last Modified15 November 2012
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC12H10N2O2S
Net Charge0
Average Mass246.291
Monoisotopic Mass246.04630
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)/t10-/m1/s1
InChIKeyGTTVJFCVXYCPHB-SNVBAGLBSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(S)-dihydrocamalexic acid (CHEBI:47796) is a dihydrocamalexic acid (CHEBI:47794)
(S)-dihydrocamalexic acid (CHEBI:47796) is conjugate acid of (S)-dihydrocamalexate (CHEBI:71048)
(S)-dihydrocamalexic acid (CHEBI:47796) is enantiomer of (R)-dihydrocamalexic acid (CHEBI:47795)
Incoming Relation(s)
(S)-dihydrocamalexate (CHEBI:71048) is conjugate base of (S)-dihydrocamalexic acid (CHEBI:47796)
(R)-dihydrocamalexic acid (CHEBI:47795) is enantiomer of (S)-dihydrocamalexic acid (CHEBI:47796)
Synonym  Source
(4S)-2-(1H-indol-3-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acidChEBI
Citations