CHEBI:81929 - MCPA-thioethyl

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name MCPA-thioethyl
ChEBI ID CHEBI:81929
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C11H13ClO2S
Net Charge 0
Average Mass 244.73800
Monoisotopic Mass 244.03248
InChI InChI=1S/C11H13ClO2S/c1-3-15-11(13)7-14-10-5-4-9(12)6-8(10)2/h4-6H,3,7H2,1-2H3
InChIKey AZFKQCNGMSSWDS-UHFFFAOYSA-N
SMILES CCSC(=O)COc1ccc(Cl)cc1C
Roles Classification
Application(s): phenoxy herbicide
Any member of the class of herbicides whose members contain a phenoxy or substituted phenoxy group.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing MCPA-thioethyl (CHEBI:81929) has role phenoxy herbicide (CHEBI:60575)
MCPA-thioethyl (CHEBI:81929) is a aromatic ether (CHEBI:35618)
Manual Xrefs Databases
1124 PPDB
C18741 KEGG COMPOUND
View more database links
Registry Number Type Source
25319-90-8 CAS Registry Number KEGG COMPOUND
Last Modified
18 November 2019