EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:183391 - methyl 2-[(2-methoxyacetyl)amino]thiophene-3-carboxylate

ChEBI IDCHEBI:183391
ChEBI Namemethyl 2-[(2-methoxyacetyl)amino]thiophene-3-carboxylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H11NO4S
Net Charge0
Average Mass229.257
Monoisotopic Mass229.04088
SMILESCOCC(=O)Nc1sccc1C(=O)OC
InChIInChI=1S/C9H11NO4S/c1-13-5-7(11)10-8-6(3-4-15-8)9(12)14-2/h3-4H,5H2,1-2H3,(H,10,11)
InChIKeyYDCNSINAIASMSA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
methyl 2-[(2-methoxyacetyl)amino]thiophene-3-carboxylate (CHEBI:183391) is a thiophenecarboxylic acid (CHEBI:48436)
IUPAC Name 
methyl 2-[(2-methoxyacetyl)amino]thiophene-3-carboxylate
Manual XrefsDatabases
2087031ChemSpider