CHEBI:169108 - 2-(4-Methyl-5-thiazolyl)ethyl propionate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-(4-Methyl-5-thiazolyl)ethyl propionate
ChEBI ID CHEBI:169108
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C9H13NO2S
Net Charge 0
Average Mass 199.270
Monoisotopic Mass 199.06670
InChI InChI=1S/C9H13NO2S/c1-3-9(11)12-5-4-8-7(2)10-6-13-8/h6H,3-5H2,1-2H3
InChIKey KXYXTLJGFPUWOE-UHFFFAOYSA-N
SMILES S1C(CCOC(=O)CC)=C(N=C1)C
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing 2-(4-Methyl-5-thiazolyl)ethyl propionate (CHEBI:169108) is a thiazoles (CHEBI:48901)
IUPAC Name
2-(4-methyl-1,3-thiazol-5-yl)ethyl propanoate
Manual Xrefs Databases
21105956 ChemSpider
HMDB0032424 HMDB
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Registry Number Type Source
324742-96-3 CAS Registry Number ChemIDplus