COMPOUND: C14779
Help
Entry
C14779 Compound
Name
9(S)-HETE;
(5Z,7E,11Z,14Z)-(9S)-9-Hydroxyeicosa-5,7,11,14-tetraenoic acid;
(5Z,7E,11Z,14Z)-(9S)-9-Hydroxyicosa-5,7,11,14-tetraenoic acid
Formula
C20H32O3
Exact mass
320.2351
Mol weight
320.4663
Structure
Mol file
KCF file
DB search
Pathway
map00590
Arachidonic acid metabolism
Brite
Lipids [BR:
br08002
]
FA Fatty acyls
FA03 Eicosanoids
FA0306 Hydroxy/hydroperoxyeicosatetraenoic acids
C14779 9(S)-HETE
BRITE hierarchy
Other DBs
CAS:
107656-13-3
PubChem:
17395777
ChEBI:
34495
LIPIDMAPS:
LMFA03060027
KNApSAcK:
C00000420
NIKKAJI:
J852.254E
LinkDB
All DBs
KCF data
Show
ATOM 23
1 C2b C 19.5315 -16.5055
2 C1c C 20.9282 -16.5055
3 C2b C 18.3172 -17.2073
4 C1b C 22.1423 -17.2073
5 C2b C 17.1101 -16.5055
6 C2b C 23.3566 -16.5055
7 C2b C 15.7065 -16.5055
8 C2b C 24.7533 -16.5055
9 C1b C 14.5062 -17.2073
10 C1b C 25.9673 -17.2073
11 C1b C 13.2850 -16.5055
12 C2b C 27.1745 -16.5055
13 C1b C 12.0707 -17.2073
14 C2b C 28.5783 -16.5055
15 C6a C 10.8636 -16.5055
16 C1b C 29.7924 -17.2073
17 O6a O 9.6495 -17.2073
18 O6a O 10.8636 -15.1086
19 C1b C 30.9996 -16.5055
20 C1b C 32.2139 -17.2073
21 C1b C 33.4210 -16.5055
22 C1a C 34.6353 -17.2073
23 O1a O 21.2874 -14.6064
BOND 22
1 1 2 1
2 1 3 2
3 2 4 1
4 3 5 1
5 4 6 1
6 5 7 2
7 6 8 2
8 7 9 1
9 8 10 1
10 9 11 1
11 10 12 1
12 11 13 1
13 12 14 2
14 13 15 1
15 14 16 1
16 15 17 1
17 15 18 2
18 16 19 1
19 19 20 1
20 20 21 1
21 21 22 1
22 2 23 1 #Up
» Japanese version
DBGET
integrated database retrieval system