CHEBI:223674 - 4 S, 5S-Talactone C

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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 4 S, 5S-Talactone C
ChEBI ID CHEBI:223674
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H12O4
Net Charge 0
Average Mass 172.180
Monoisotopic Mass 172.07356
InChI InChI=1S/C8H12O4/c1-5(4-9)8-6(11-2)3-7(10)12-8/h3,5,8-9H,4H2,1-2H3/t5-,8+/m1/s1
InChIKey WZCPWPCNJXKSRY-XRGYYRRGSA-N
SMILES O=C1O[C@@H]([C@@H](CO)C)C(=C1)OC
Metabolite of Species Details
Talaromyces (NCBI:txid5094) See: PubMed
ChEBI Ontology
Outgoing 4 S, 5S-Talactone C (CHEBI:223674) is a butenolide (CHEBI:50523)
IUPAC Name
(2S)-2-[(2R)-1-hydroxypropan-2-yl]-3-methoxy-2H-uran-5-one