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CHEBI:33214 - ethylmercurithiosalicylic acid

ChEBI IDCHEBI:33214
ChEBI Nameethylmercurithiosalicylic acid
Stars
Last Modified25 February 2016
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC9H10HgO2S
Net Charge0
Average Mass382.834
Monoisotopic Mass384.01079
SMILESC[CH2][Hg][S]c1ccccc1C(=O)O
InChIInChI=1S/C7H6O2S.C2H5.Hg/c8-7(9)5-3-1-2-4-6(5)10;1-2;/h1-4,10H,(H,8,9);1H2,2H3;/q;;+1/p-1
InChIKeyHXQVQGWHFRNKMS-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
ethylmercurithiosalicylic acid (CHEBI:33214) is a alkylmercury compound (CHEBI:33255)
ethylmercurithiosalicylic acid (CHEBI:33214) is conjugate acid of ethylmercurithiosalicylate (CHEBI:33215)
Incoming Relation(s)
ethylmercurithiosalicylate (CHEBI:33215) is conjugate base of ethylmercurithiosalicylic acid (CHEBI:33214)
IUPAC Name 
[(2-carboxyphenyl)sulfanyl](ethyl)mercury
Synonyms  Source
2-(ETHYLMERCURI-THIO)-BENZOIC ACIDPDBeChem
[(o-carboxyphenyl)thio]ethylmercuryChEBI
2-(ethylmercuriothio)benzoic acidChemIDplus
Manual XrefsDatabases
EMTPDBeChem
DB02731DrugBank
LSM-5710LINCS
Registry NumbersSources
Beilstein:4139322Beilstein
CAS:148-61-8ChemIDplus