COMPOUND: C04822
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Entry
C04822 Compound
Name
8(R)-HPETE;
(5Z,9E,11Z,14Z)-(8R)-8-Hydroperoxyeicosa-5,9,11,14-tetraenoate;
(5Z,9E,11Z,14Z)-(8R)-8-Hydroperoxyicosa-5,9,11,14-tetraenoate
Formula
C20H32O4
Exact mass
336.2301
Mol weight
336.4657
Structure
Mol file
KCF file
DB search
Reaction
R01594
Pathway
map00590
Arachidonic acid metabolism
map04726
Serotonergic synapse
Enzyme
1.13.11.40
Brite
Lipids [BR:
br08002
]
FA Fatty acyls
FA03 Eicosanoids
FA0306 Hydroxy/hydroperoxyeicosatetraenoic acids
C04822 8(R)-HPETE
BRITE hierarchy
Other DBs
PubChem:
7383
ChEBI:
15629
LIPIDMAPS:
LMFA03060037
3DMET:
B01793
NIKKAJI:
J1.084.991H
LinkDB
All DBs
KCF data
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ATOM 24
1 C2b C 27.7900 -22.4000
2 C2b C 26.5300 -22.4000
3 C1b C 28.9100 -23.0300
4 C1b C 25.4800 -23.0300
5 C1b C 30.0300 -22.4000
6 C1c C 24.3600 -22.4000
7 C1b C 31.0800 -23.0300
8 C6a C 32.2000 -22.4000
9 O6a O 33.2500 -23.0300
10 O6a O 32.2000 -21.1400
11 C2b C 23.1700 -23.1000
12 C2b C 21.9800 -22.4000
13 C2b C 20.7900 -23.1000
14 C2b C 20.7900 -24.5000
15 C1b C 22.0500 -25.2000
16 C2b C 23.2400 -24.4300
17 C2b C 24.5000 -24.4300
18 C1b C 25.7600 -25.1300
19 C1b C 26.9500 -24.4300
20 C1b C 28.1400 -25.1300
21 C1b C 29.4000 -24.4300
22 C1a C 30.5900 -25.1300
23 O2a O 24.3465 -21.0001
24 O1a O 25.3400 -20.0200
BOND 23
1 1 2 2
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 1
6 5 7 1
7 7 8 1
8 8 9 1
9 8 10 2
10 6 11 1
11 11 12 2
12 12 13 1
13 13 14 2
14 14 15 1
15 15 16 1
16 16 17 2
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 21 22 1
22 6 23 1 #Down
23 23 24 1
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