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CHEBI:177507 - treloxinate

ChEBI IDCHEBI:177507
ChEBI Nametreloxinate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H12Cl2O4
Net Charge0
Average Mass339.174
Monoisotopic Mass338.01126
SMILESCOC(=O)C1Oc2ccc(Cl)cc2Cc2cc(Cl)ccc2O1
InChIInChI=1S/C16H12Cl2O4/c1-20-15(19)16-21-13-4-2-11(17)7-9(13)6-10-8-12(18)3-5-14(10)22-16/h2-5,7-8,16H,6H2,1H3
InChIKeyBORQIQWYKSNHKN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
treloxinate (CHEBI:177507) is a organochlorine compound (CHEBI:36683)
IUPAC Name 
methyl 3,7-dichloro-5H-benzo[d][1,3]benzodioxocine-11-carboxylate
Manual XrefsDatabases
32817ChemSpider
D06209KEGG DRUG
Registry NumbersSources
CAS:30910-27-1ChemIDplus