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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 C
17
H
23
NO
4
, 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
(3
Z
)-
3-
[(2
E
,4
E
,6
E
)-
1-
hydroxydodeca-
2,4,6-
trien-
1-
ylidene]-
5-
(hydroxymethyl)pyrrolidine-
2,4-
dione
Citation
Type
Source
26414728
PubMed citation
Europe PMC
Last Modified
01 November 2016