CHEBI:33214 - ethylmercurithiosalicylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ethylmercurithiosalicylic acid
ChEBI ID CHEBI:33214
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C9H10HgO2S
Net Charge 0
Average Mass 382.83050
Monoisotopic Mass 384.01079
InChI InChI=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
InChIKey HXQVQGWHFRNKMS-UHFFFAOYSA-M
SMILES CC[Hg]Sc1ccccc1C(O)=O
ChEBI Ontology
Outgoing ethylmercurithiosalicylic acid (CHEBI:33214) is a alkylmercury compound (CHEBI:33255)
ethylmercurithiosalicylic acid (CHEBI:33214) is conjugate acid of ethylmercurithiosalicylate (CHEBI:33215)
Incoming ethylmercurithiosalicylate (CHEBI:33215) is conjugate base of ethylmercurithiosalicylic acid (CHEBI:33214)
IUPAC Name
[(2-carboxyphenyl)sulfanyl](ethyl)mercury
Synonyms Sources
2-(ETHYLMERCURI-THIO)-BENZOIC ACID PDBeChem
2-(ethylmercuriothio)benzoic acid ChemIDplus
[(o-carboxyphenyl)thio]ethylmercury ChEBI
Manual Xrefs Databases
DB02731 DrugBank
EMT PDBeChem
LSM-5710 LINCS
View more database links
Registry Numbers Types Sources
148-61-8 CAS Registry Number ChemIDplus
4139322 Beilstein Registry Number Beilstein
Last Modified
25 February 2016