CHEBI:68229 - pinselin

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ChEBI Name pinselin
ChEBI ID CHEBI:68229
Definition A member of the class of xanthones that is methyl 9H-xanthene-1-carboxylate substituted by hydroxy groups at positions 2 and 8, a methyl group at position 6 and an oxo group at position 9. It has been isolated from Aspergillus sydowii.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H12O6
Net Charge 0
Average Mass 300.26290
Monoisotopic Mass 300.06339
InChI InChI=1S/C16H12O6/c1-7-5-9(18)12-11(6-7)22-10-4-3-8(17)13(16(20)21-2)14(10)15(12)19/h3-6,17-18H,1-2H3
InChIKey TWQNCGDOHUNFFU-UHFFFAOYSA-N
SMILES COC(=O)c1c(O)ccc2oc3cc(C)cc(O)c3c(=O)c12
Metabolite of Species Details
Aspergillus sydowii (NCBI:txid75750) Ethyl acetate extract of culture broth, fungus isolated from a sea fan, Annella sp. of strain PSU F154 See: PubMed
Roles Classification
Biological Role(s): Aspergillus metabolite
Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pinselin (CHEBI:68229) has role Aspergillus metabolite (CHEBI:76956)
pinselin (CHEBI:68229) is a carboxylic ester (CHEBI:33308)
pinselin (CHEBI:68229) is a polyphenol (CHEBI:26195)
pinselin (CHEBI:68229) is a xanthones (CHEBI:51149)
IUPAC Name
methyl 2,8-dihydroxy-6-methyl-9-oxo-9H-xanthene-1-carboxylate
Registry Numbers Types Sources
305759 Reaxys Registry Number Reaxys
476-53-9 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
21718031 PubMed citation Europe PMC
Last Modified
13 January 2014