KEGG   COMPOUND: C14832Help
Entry
C14832                      Compound                               

Name
12,13-Epoxy-9-hydroxy-10-octadecenoate;
12(R),13(S)-Epoxy-9(S)-hydroxy-10(E)-octadecenoic acid;
(10E)-(9S,12R,13S)-12,13-Epoxy-9-hydroxyoctadec-10-enoic acid
Formula
C18H32O4
Exact mass
312.2301
Mol weight
312.4443
Structure
Mol fileKCF fileDB searchJmolKegDraw
Pathway
Linoleic acid metabolism
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA02 Octadecanoids
   FA0200 Other Octadecanoids
    C14832  (10E)-(9S,12R,13S)-12,13-Epoxy-9-hydroxyoctadec-10-enoic acid
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
NIKKAJI: 
KCF data Show

ATOM        22
            1   C2b C    28.5600  -24.2900
            2   C2b C    29.8200  -23.6600
            3   C1y C    31.1500  -24.2200
            4   C1y C    32.6200  -24.2200
            5   C1b C    33.8100  -23.5900
            6   C1b C    35.0000  -24.2200
            7   C1b C    36.2600  -23.5200
            8   C1b C    37.4500  -24.1500
            9   C1a C    38.6400  -23.5200
            10  C1c C    27.1600  -24.2900
            11  C1b C    23.5900  -23.5900
            12  C1b C    22.4000  -24.2900
            13  C1b C    21.1400  -23.5900
            14  C1b C    19.9500  -24.2900
            15  C1b C    18.7600  -23.5900
            16  C6a C    17.5700  -24.2900
            17  O6a O    16.3100  -23.5900
            18  O6a O    17.5700  -25.8300
            19  C1b C    24.7800  -24.2900
            20  C1b C    25.9700  -23.5900
            21  O1a O    26.7922  -26.0608
            22  O2x O    31.8500  -25.6900
BOND        22
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     1  10 1
            10   11  12 1
            11   12  13 1
            12   13  14 1
            13   14  15 1
            14   15  16 1
            15   16  17 1
            16   16  18 2
            17   11  19 1
            18   19  20 1
            19   20  10 1
            20   10  21 1 #Up
            21    3  22 1 #Down
            22    4  22 1 #Down

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