KEGG   COMPOUND: C22503
Entry
C22503                      Compound                               
Name
8-[(1R,2R)-3-Oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate;
8-[(1R,2R)-3-Oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoic acid;
(9R,13R)-10,11-Dihydro-12-oxo-15-phytoenoate
Formula
C18H30O3
Exact mass
294.2195
Mol weight
294.429
Structure
Reaction
R12992
Enzyme
1.3.1.42
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA02 Octadecanoids
   FA0201 12-oxophytodienoic acid metabolites
    C22503  8-[(1R,2R)-3-Oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoic acid
Other DBs
ChEBI: 15720 49265
KCF data

ATOM        21
            1   C1y C    14.2100  -14.7700
            2   C1y C    14.2100  -16.1699
            3   C1x C    12.8800  -14.3500
            4   C1b C    15.4699  -14.0000
            5   C5x C    12.9500  -16.5899
            6   C1b C    15.4699  -16.8699
            7   C1x C    12.1100  -15.4699
            8   C1b C    16.6599  -14.7000
            9   O5x O    12.5300  -17.9199
            10  C2b C    16.6599  -16.1699
            11  C1b C    17.8499  -14.0000
            12  C2b C    18.0599  -16.1699
            13  C1b C    19.1099  -14.7000
            14  C1b C    19.2499  -16.8699
            15  C1b C    20.2299  -14.0000
            16  C1a C    20.5099  -16.0999
            17  C1b C    21.4899  -14.7000
            18  C1b C    22.6799  -14.0000
            19  C6a C    23.8699  -14.7000
            20  O6a O    25.1299  -14.0000
            21  O6a O    23.8699  -16.0999
BOND        21
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     4   8 1
            8     5   9 2
            9     6  10 1
            10    8  11 1
            11   10  12 2
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   14  16 1
            16   15  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   19  21 2
            21    5   7 1

» Japanese version

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Chemical substance (2)   
   ChEBI (2)   
Chemical reaction (2)   
   KEGG ENZYME (1)   
   KEGG REACTION (1)   
Gene (1305)   
   KEGG GENES (1305)   
All databases (1309)   

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