CHEBI:68010 - lehualide J

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ChEBI Name lehualide J
ChEBI ID CHEBI:68010
Definition A member of the class of 2-pyranones that is 2H-pyran-2-one substituted by methoxy groups at positions 3 and 4, a methyl group at position 5 and a 10-(methylsulfinyl)decyl group at position 6. It has been isolated from the marine sponge of the genus Plakortis.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C19H32O5S
Net Charge 0
Average Mass 372.51900
Monoisotopic Mass 372.19705
InChI InChI=1S/C19H32O5S/c1-15-16(24-19(20)18(23-3)17(15)22-2)13-11-9-7-5-6-8-10-12-14-25(4)21/h5-14H2,1-4H3
InChIKey CNSMFTLWDBUIIS-UHFFFAOYSA-N
SMILES COc1c(C)c(CCCCCCCCCCS(C)=O)oc(=O)c1OC
Metabolite of Species Details
Plakortis (NCBI:txid86044) Methanolic extract of frozen sample See: PubMed
Roles Classification
Biological Role(s): animal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing lehualide J (CHEBI:68010) has role animal metabolite (CHEBI:75767)
lehualide J (CHEBI:68010) is a 2-pyranones (CHEBI:75885)
lehualide J (CHEBI:68010) is a ether (CHEBI:25698)
lehualide J (CHEBI:68010) is a polyketide (CHEBI:26188)
lehualide J (CHEBI:68010) is a sulfoxide (CHEBI:22063)
IUPAC Name
3,4-dimethoxy-5-methyl-6-[10-(methylsulfinyl)decyl]-2H-pyran-2-one
Registry Number Type Source
21452353 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21351759 PubMed citation Europe PMC
Last Modified
17 March 2014