KEGG   COMPOUND: C13791
Entry
C13791                      Compound                               
Name
(6R,7S)-6,7-Epoxyoctadecanoic acid;
6R,7S-Epoxy-octadecanoic acid;
6R,7S-Epoxy-octadecanoate
Formula
C18H34O3
Exact mass
298.2508
Mol weight
298.4608
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA02 Octadecanoids
   FA0200 Other Octadecanoids
    C13791  (6R,7S)-6,7-Epoxyoctadecanoic acid
Other DBs
PubChem: 854036
ChEBI: 34004
LIPIDMAPS: LMFA02000275
3DMET: B04578
NIKKAJI: J2.786.441D
LinkDB
KCF data

ATOM        21
            1   O6a O    17.7846  -17.7192
            2   C6a C    19.0164  -17.0080
            3   C1b C    20.2481  -17.7192
            4   C1b C    21.4799  -17.0080
            5   C1b C    22.7117  -17.7192
            6   C1b C    23.9435  -17.0080
            7   C1y C    25.1754  -17.7192
            8   O6a O    19.0164  -15.5857
            9   C1y C    26.4536  -17.7192
            10  C1b C    27.6853  -17.0080
            11  C1b C    28.9171  -17.7192
            12  C1b C    30.1490  -17.0080
            13  C1b C    31.3808  -17.7192
            14  C1b C    32.6124  -17.0080
            15  C1b C    33.8443  -17.7192
            16  C1b C    35.0761  -17.0080
            17  C1b C    36.3078  -17.7192
            18  C1b C    37.5397  -17.0080
            19  C1b C    38.7888  -17.7192
            20  C1a C    40.0215  -17.0080
            21  O2x O    25.9119  -18.7925
BOND        21
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     7   6 1 #Down
            7     2   8 2
            8     9  10 1 #Down
            9    10  11 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   17  18 1
            17   18  19 1
            18   19  20 1
            19    7   9 1
            20    7  21 1
            21    9  21 1

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