CHEBI:198821 - Anithiactin A

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ChEBI Name Anithiactin A
ChEBI ID CHEBI:198821
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C12H12N2O2S
Net Charge 0
Average Mass 248.300
Monoisotopic Mass 248.06195
InChI InChI=1S/C12H12N2O2S/c1-13-9-6-4-3-5-8(9)11-14-10(7-17-11)12(15)16-2/h3-7,13H,1-2H3
InChIKey GADWTAUYJRJWRT-UHFFFAOYSA-N
SMILES S1C(=NC(=C1)C(=O)OC)C2=C(NC)C=CC=C2
Metabolite of Species Details
Actinomycetospora (NCBI:txid402649) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Anithiactin A (CHEBI:198821) is a aromatic carboxylic acid (CHEBI:33859)
Anithiactin A (CHEBI:198821) is a thiazoles (CHEBI:48901)
IUPAC Name
methyl 2-[2-(methylamino)phenyl]-1,3-thiazole-4-carboxylate
Manual Xref Database
34981156 ChemSpider
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