KEGG   COMPOUND: C07355
Entry
C07355                      Compound                               
Name
(9Z)-(7S,8S)-Dihydroxyoctadecenoic acid;
(Z)-(7S,8S)-Dihydroxyoctadeca-9-enoic acid;
(Z)-(7S,8S)-Dihydroxyoctadeca-9-enoate
Formula
C18H34O4
Exact mass
314.2457
Mol weight
314.4602
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0105 Hydroxy fatty acids
    C07355  (9Z)-(7S,8S)-Dihydroxyoctadecenoic acid
  FA02 Octadecanoids
   FA0200 Other Octadecanoids
    C07355  (9Z)-(7S,8S)-Dihydroxyoctadecenoic acid
Other DBs
PubChem: 9560
ChEBI: 448
LIPIDMAPS: LMFA01050451 LMFA02000225
3DMET: B02119
NIKKAJI: J2.765.043K
LinkDB
KCF data

ATOM        22
            1   C1c C    24.1431  -17.3866
            2   C1c C    25.3540  -18.0787
            3   C1b C    22.9319  -18.0849
            4   O1a O    24.1431  -15.9841
            5   C2b C    26.5652  -17.3743
            6   O1a O    25.3603  -19.4814
            7   C1b C    21.7209  -17.3929
            8   C2b C    27.9679  -17.3743
            9   C1b C    20.5097  -18.0910
            10  C1b C    29.1789  -18.0787
            11  C1b C    19.2986  -17.3990
            12  C1b C    30.3962  -17.3743
            13  C1b C    18.0876  -18.0973
            14  C1b C    31.6073  -18.0787
            15  C6a C    16.8764  -17.4053
            16  C1b C    32.8185  -17.3743
            17  O6a O    15.6653  -18.1097
            18  O6a O    16.8703  -16.0025
            19  C1b C    34.0295  -18.0787
            20  C1b C    35.2407  -17.3743
            21  C1b C    36.4516  -18.0787
            22  C1a C    37.6628  -17.3743
BOND        21
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     5   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 1
            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

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