CHEBI:133781 - pyranonigrin J

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ChEBI Name pyranonigrin J
ChEBI ID CHEBI:133781
Definition A member of the class of pyrrolidin-2-ones with formula C17H23NO4, originally isolated from Aspergillus niger.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Julian Brandl
Supplier Information
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Formula C17H23NO4
Net Charge 0
Average Mass 305.369
Monoisotopic Mass 305.16271
InChI InChI=1S/C17H23NO4/c1-2-3-4-5-6-7-8-9-10-11-14(20)15-16(21)13(12-19)18-17(15)22/h6-11,13,19-20H,2-5,12H2,1H3,(H,18,22)/b7-6+,9-8+,11-10+,15-14-
InChIKey RUURYCUIDCAXSP-OSDNNVOJSA-N
SMILES C(=C/C=C/CCCCC)\C=C\C(=C\1/C(C(NC1=O)CO)=O)\O
Metabolite of Species Details
Aspergillus niger ATCC 1015 (NCBI:txid380704) of strain AnKW2 See: PubMed
Roles Classification
Biological Role(s): marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
Aspergillus metabolite
Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pyranonigrin J (CHEBI:133781) has role Aspergillus metabolite (CHEBI:76956)
pyranonigrin J (CHEBI:133781) has role marine metabolite (CHEBI:76507)
pyranonigrin J (CHEBI:133781) is a enol (CHEBI:33823)
pyranonigrin J (CHEBI:133781) is a primary alcohol (CHEBI:15734)
pyranonigrin J (CHEBI:133781) is a pyrrolidin-2-ones (CHEBI:74223)
IUPAC Name
(3Z)-3-[(2E,4E,6E)-1-hydroxydodeca-2,4,6-trien-1-ylidene]-5-(hydroxymethyl)pyrrolidine-2,4-dione
Citation Waiting for Citations Type Source
26414728 PubMed citation Europe PMC
Last Modified
01 November 2016