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CHEBI:216295 - Indolokine A5

ChEBI IDCHEBI:216295
ChEBI NameIndolokine A5
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SubmitterMetaboLights
DownloadsMolfile
FormulaC13H8N2O3S
Net Charge0
Average Mass272.285
Monoisotopic Mass272.02556
SMILESO=C(O)c1csc(C(=O)c2cnc3ccccc23)n1
InChIInChI=1S/C13H8N2O3S/c16-11(12-15-10(6-19-12)13(17)18)8-5-14-9-4-2-1-3-7(8)9/h1-6,14H,(H,17,18)
InChIKeyFWXYUFQKPJMQEC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (32243812)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Indolokine A5 (CHEBI:216295) is a indolyl carboxylic acid (CHEBI:46867)
IUPAC Name 
2-(1H-indole-3-carbonyl)-1,3-thiazole-4-carboxylic acid
Manual XrefsDatabases
114826534ChemSpider