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CHEBI:201900 - Dimethachlor Metabolite SYN 530561

ChEBI IDCHEBI:201900
ChEBI NameDimethachlor Metabolite SYN 530561
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SubmitterMetaboLights
DownloadsMolfile
FormulaC13H17NO5
Net Charge0
Average Mass267.281
Monoisotopic Mass267.11067
SMILESCOCCN(C(=O)CO)c1c(C)cccc1C(=O)O
InChIInChI=1S/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)
InChIKeyUJKHCLQXFACPDB-UHFFFAOYSA-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)
Dimethachlor Metabolite SYN 530561 (CHEBI:201900) is a amidobenzoic acid (CHEBI:48470)
IUPAC Name 
2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid
Manual XrefsDatabases
35804512ChemSpider