CHEBI:204345 - Furanone B

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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 Furanone B
ChEBI ID CHEBI:204345
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H16O4
Net Charge 0
Average Mass 236.267
Monoisotopic Mass 236.10486
InChI InChI=1S/C13H16O4/c1-4-5-10-9(6-7-11(14)15)12(16)13(17-10)8(2)3/h6-7H,4-5H2,1-3H3,(H,14,15)/b7-6+
InChIKey NPEVDKHQEYSYTP-VOTSOKGWSA-N
SMILES O=C1C(OC(=C1/C=C/C(=O)O)CCC)=C(C)C
Metabolite of Species Details
Lactobacillus helveticus (NCBI:txid1587) See: PubMed
ChEBI Ontology
Outgoing Furanone B (CHEBI:204345) is a oxolanes (CHEBI:26912)
IUPAC Name
(E)-3-(4-oxo-5-propan-2-ylidene-2-propyluran-3-yl)prop-2-enoic acid
Manual Xref Database
77001848 ChemSpider
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