COMPOUND: C14732
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Entry
C14732 Compound
Name
5-OxoETE;
(6E,8Z,11Z,14Z)-5-Oxoicosa-6,8,11,14-tetraenoic acid;
5-Oxoeicosatetraenoic acid;
5-Oxoicosatetraenoic acid
Formula
C20H30O3
Exact mass
318.2195
Mol weight
318.45
Structure
Mol file
KCF file
DB search
Reaction
R13040
Pathway
map00590
Arachidonic acid metabolism
map01100
Metabolic pathways
Enzyme
1.1.1.-
Brite
Lipids [BR:
br08002
]
FA Fatty acyls
FA03 Eicosanoids
FA0306 Hydroxy/hydroperoxyeicosatetraenoic acids
C14732 5-OxoETE
BRITE hierarchy
Other DBs
PubChem:
17395731
ChEBI:
52449
LIPIDMAPS:
LMFA03060011
NIKKAJI:
J661.539B
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KCF data
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ATOM 23
1 C5a C 22.3596 -14.8102
2 C2b C 21.0755 -14.8160
3 C1b C 23.4604 -15.4552
4 O5a O 22.3301 -13.4843
5 C2b C 19.9629 -15.4731
6 C1b C 24.5672 -14.8102
7 C2b C 18.8444 -14.8279
8 C1b C 25.6739 -15.4552
9 C2b C 17.5719 -14.8339
10 C6a C 26.7806 -14.8102
11 C1b C 16.4711 -16.9940
12 O6a O 27.8932 -15.4494
13 O6a O 26.7806 -13.5319
14 C2b C 17.4891 -19.1956
15 C2b C 18.7734 -19.1896
16 C1b C 19.8742 -18.5386
17 C2b C 20.9866 -19.1719
18 C2b C 22.2532 -19.1659
19 C1b C 23.3481 -18.5209
20 C1b C 24.4428 -19.1541
21 C1b C 25.5378 -18.5149
22 C1b C 26.6385 -19.1482
23 C1a C 27.7334 -18.5031
BOND 22
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 3 6 1
6 5 7 1
7 6 8 1
8 7 9 2
9 8 10 1
10 9 11 1
11 10 12 1
12 10 13 2
13 11 14 1
14 14 15 2
15 15 16 1
16 16 17 1
17 17 18 2
18 18 19 1
19 19 20 1
20 20 21 1
21 21 22 1
22 22 23 1
ยป Japanese version
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