CHEBI:228439 - TLH

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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 TLH
ChEBI ID CHEBI:228439
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H11F3O3S
Net Charge 0
Average Mass 292.270
Monoisotopic Mass 292.03810
InChI InChI=1S/C12H11F3O3S/c1-4-6(2)5-11(3)8(16)7(10(18)19-11)9(17)12(13,14)15/h4-5,17H,1H2,2-3H3/b6-5+,9-7-/t11-/m1/s1
InChIKey KFHDKRDOPDFDAQ-MPCKHMOWSA-N
SMILES S1[C@](C(=O)/C(/C1=O)=C(/O)\C(F)(F)F)(C)/C=C(\C)/C=C
Metabolite of Species Details
Zea mays (NCBI:txid4577) Found in exometabolome See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaboLights Study
ChEBI Ontology
Outgoing TLH (CHEBI:228439) is a tetrahydrothiophenes (CHEBI:48224)
IUPAC Name
(3Z,5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]-3-(2,2,2-triluoro-1-hydroxyethylidene)thiolane-2,4-dione