KEGG   COMPOUND: C14767Help
Entry
C14767                      Compound                               

Name
9(S)-HODE;
(9S)-Hydroxyoctadecadienoic acid;
(10E,12Z)-(9S)-9-Hydroxyoctadeca-10,12-dienoic acid
Formula
C18H32O3
Exact mass
296.2351
Mol weight
296.4449
Structure
Mol fileKCF fileDB searchJmolKegDraw
Pathway
Linoleic acid metabolism
PPAR signaling pathway
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA02 Octadecanoids
   FA0200 Other Octadecanoids
    C14767  (10E,12Z)-(9S)-9-Hydroxyoctadeca-10,12-dienoic acid
BRITE hierarchy
Other DBs
CAS: 
73543-67-6
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
PDB-CCD: 
NIKKAJI: 
KCF data Show

ATOM        21
            1   C1b C    19.5050  -16.4800
            2   C1b C    20.7235  -17.1773
            3   C1b C    18.2803  -17.1835
            4   C1c C    21.9486  -16.4737
            5   C1b C    17.0616  -16.4863
            6   C2b C    23.1436  -17.1098
            7   C1b C    15.8429  -17.1898
            8   C2b C    24.3809  -16.5035
            9   C1b C    14.6244  -16.4925
            10  C2b C    25.7408  -17.0722
            11  C1b C    13.3997  -17.1960
            12  C2b C    27.2186  -17.0722
            13  C6a C    12.1809  -16.4990
            14  C1b C    28.4559  -16.4013
            15  O6a O    10.9561  -17.2024
            16  O6a O    12.1746  -15.0980
            17  C1b C    29.6493  -17.0092
            18  C1b C    30.8869  -16.3262
            19  C1b C    32.0803  -16.9338
            20  C1a C    33.3176  -16.3214
            21  O1a O    22.0096  -14.8326
BOND        20
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     5   7 1
            7     6   8 2
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11   10  12 2
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 2
            16   14  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20    4  21 1 #Down

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