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CHEBI:46109 - (5R)-5-[(1E)-BUTA-1,3-DIENYL]-4-HYDROXY-3,5-DIMETHYLTHIOPHEN-2(5H)-ONE

Default Structure
ChEBI IDCHEBI:46109
ChEBI Name(5R)-5-[(1E)-BUTA-1,3-DIENYL]-4-HYDROXY-3,5-DIMETHYLTHIOPHEN-2(5H)-ONE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC10H12O2S
Net Charge0
Average Mass196.271
Monoisotopic Mass196.05580
SMILES[H]OC1=C(C([H])([H])[H])C(=O)S[C@@]1(/C([H])=C(\[H])C([H])=C([H])[H])C([H])([H])[H]
InChIInChI=1S/C10H12O2S/c1-4-5-6-10(3)8(11)7(2)9(12)13-10/h4-6,11H,1H2,2-3H3/b6-5+/t10-/m1/s1
InChIKeyTXGVAQMIEXZDPM-BRAIEQGRSA-N
ChEBI Ontology
Outgoing Relation(s)
(5R)-5-[(1E)-BUTA-1,3-DIENYL]-4-HYDROXY-3,5-DIMETHYLTHIOPHEN-2(5H)-ONE (CHEBI:46109) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(5R)-5-[(1E)-buta-1,3-dien-1-yl]-4-hydroxy-3,5-dimethylthiophen-2(5H)-onePDBeChem
(5R)-5-[(1E)-BUTA-1,3-DIENYL]-4-HYDROXY-3,5-DIMETHYLTHIOPHEN-2(5H)-ONEPDBeChem
Manual XrefsDatabases
TL6PDBeChem