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> Main
CHEBI:131617 - 18-oxoresolvin E1
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ChEBI Name
18-oxoresolvin E1
ChEBI ID
CHEBI:131617
Definition
A nonclassic icosanoid that is (6
Z
,8
E
,10
E
,14
Z
,16
E
)-icosa-6,8,10,14,16-pentaenoic acid carrying two hydroxy groups at positions 5 and 12 as well as an oxo group at position 18.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C20H28O5
Net Charge
0
Average Mass
348.434
Monoisotopic Mass
348.19367
InChI
InChI=1S/C20H28O5/c1-
2-
17(21)
11-
8-
5-
9-
14-
18(22)
12-
6-
3-
4-
7-
13-
19(23)
15-
10-
16-
20(24)
25/h3-
9,11-
13,18-
19,22-
23H,2,10,14-
16H2,1H3,(H,24,25)
/b4-
3+,9-
5-
,11-
8+,12-
6+,13-
7-
/t18-
,19+/m0/s1
InChIKey
CMOJNYRANQREGD-IJDHQMKWSA-N
SMILES
C(\[C@H](CCCC(O)=O)O)=C\C=C\C=C\[C@@H](C/C=C\C=C\C(CC)=O)O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
18-oxoresolvin E1 (
CHEBI:131617
)
has role
human xenobiotic metabolite (
CHEBI:76967
)
18-oxoresolvin E1 (
CHEBI:131617
)
is a
enone (
CHEBI:51689
)
18-oxoresolvin E1 (
CHEBI:131617
)
is a
hydroxy polyunsaturated fatty acid (
CHEBI:140345
)
18-oxoresolvin E1 (
CHEBI:131617
)
is a
long-chain fatty acid (
CHEBI:15904
)
18-oxoresolvin E1 (
CHEBI:131617
)
is a
nonclassic icosanoid (
CHEBI:61703
)
18-oxoresolvin E1 (
CHEBI:131617
)
is a
oxo fatty acid (
CHEBI:59644
)
18-oxoresolvin E1 (
CHEBI:131617
)
is conjugate acid of
18-oxoresolvin E1(1−) (
CHEBI:91001
)
Incoming
18-oxoresolvin E1(1−) (
CHEBI:91001
)
is conjugate base of
18-oxoresolvin E1 (
CHEBI:131617
)
IUPAC Name
(5
S
,6
Z
,8
E
,10
E
,12
R
,14
Z
,16
E
)-
5,12-
dihydroxy-
18-
oxoicosa-
6,8,10,14,16-
pentaenoic acid
Synonyms
Sources
18-oxo-5S,12R-dihydroxy-6Z,8E,10E,14Z,16E-eicosapentaenoic acid
LIPID MAPS
18-oxo-Resolvin E1
LIPID MAPS
18-oxo-RvE1
LIPID MAPS
Manual Xref
Database
LMFA03070044
LIPID MAPS
View more database links
Citations
Types
Sources
16757471
PubMed citation
Europe PMC
18292578
PubMed citation
Europe PMC
Last Modified
05 March 2018