CHEBI:197924 - Avenaciolid 4

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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 Avenaciolid 4
ChEBI ID CHEBI:197924
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H24O4
Net Charge 0
Average Mass 268.353
Monoisotopic Mass 268.16746
InChI InChI=1S/C15H24O4/c1-3-4-5-6-7-8-9-11-12-10(2)14(16)19-13(12)15(17)18-11/h10-13H,3-9H2,1-2H3/t10-,11+,12+,13+/m0/s1
InChIKey NAWANLRIOOESSK-UMSGYPCISA-N
SMILES O=C1O[C@H](CCCCCCCC)[C@@H]2[C@H]1OC(=O)[C@H]2C
Metabolite of Species Details
Aspergillus fischeri (NCBI:txid36630) See: PubMed
ChEBI Ontology
Outgoing Avenaciolid 4 (CHEBI:197924) is a furofuran (CHEBI:47790)
IUPAC Name
(3S,3aR,4R,6aR)-3-methyl-4-octyl-3,3a,4,6a-tetrahydrouro[2,3-c]uran-2,6-dione
Manual Xref Database
78440699 ChemSpider
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