KEGG   COMPOUND: C14776
Entry
C14776                      Compound                               

Name
8(S)-HETE;
(5Z,9E,11Z,14Z)-(8S)-8-Hydroxyeicosa-5,9,11,14-tetraenoic acid;
(5Z,9E,11Z,14Z)-(8S)-8-Hydroxyicosa-5,9,11,14-tetraenoic acid
Formula
C20H32O3
Exact mass
320.2351
Mol weight
320.4663
Structure
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map03320  PPAR signaling pathway
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0306 Hydroxy/hydroperoxyeicosatetraenoic acids
    C14776  8(S)-HETE
Other DBs
CAS: 98462-03-4
PubChem: 17395774
ChEBI: 34486
LIPIDMAPS: LMFA03060006 LMFA03060086
LipidBank: DFA8131
NIKKAJI: J855.517F
KCF data

ATOM        23
            1   C1c C    19.5315  -16.5055
            2   C2b C    20.9282  -17.2055
            3   C1b C    18.3172  -17.2073
            4   C2b C    22.1423  -16.5073
            5   C2b C    17.1101  -16.5055
            6   C2b C    23.3566  -17.2055
            7   C2b C    15.7065  -16.5055
            8   C2b C    24.7533  -17.2055
            9   C1b C    14.5062  -17.2073
            10  C1b C    25.9673  -16.3673
            11  C1b C    13.2850  -16.5055
            12  C2b C    27.1745  -17.1355
            13  C1b C    12.0707  -17.2073
            14  C2b C    28.5783  -17.1355
            15  C6a C    10.8636  -16.5055
            16  C1b C    29.7924  -16.2973
            17  O6a O     9.6495  -17.2073
            18  O6a O    10.8636  -15.1086
            19  C1b C    30.9996  -17.0655
            20  C1b C    32.2139  -16.2973
            21  C1b C    33.4210  -17.0655
            22  C1a C    34.6353  -16.2973
            23  O1a O    19.1724  -15.0264
BOND        22
            1     1   2 1
            2     1   3 1
            3     2   4 2
            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    1  23 1 #Down

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Ontology (1)   
   KEGG BRITE (1)   
Pathway (3)   
   KEGG PATHWAY (3)   
Chemical substance (7)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   LipidBank (1)   
   LIPIDMAPS (2)   
   NIKKAJI (1)   
All databases (11)   

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