EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:189212 - 3-allyl-5-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one

ChEBI IDCHEBI:189212
ChEBI Name3-allyl-5-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H9N3OS2
Net Charge0
Average Mass239.325
Monoisotopic Mass239.01870
SMILESC=CCn1c(=S)sc2c(=O)nc(C)nc21
InChIInChI=1S/C9H9N3OS2/c1-3-4-12-7-6(15-9(12)14)8(13)11-5(2)10-7/h3H,1,4H2,2H3,(H,10,11,13)
InChIKeySRLUVQVTQDARDE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
3-allyl-5-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one (CHEBI:189212) is a hydroxypyrimidine (CHEBI:38340)
IUPAC Name 
5-methyl-3-prop-2-enyl-2-sulanylidene-6H-[1,3]thiazolo[4,5-d]pyrimidin-7-one
Manual XrefsDatabases
2092975ChemSpider