LMFA03050035
  LIPID_MAPS_STRUCTURE_DATABASE

 35 34  0     0  0            999 V2000
    4.8274  -10.7332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3962  -11.7194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5338  -11.7194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5338   -9.7491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3962   -9.7491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5199  -10.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5199  -11.1502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5020   -9.7491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5020  -11.7194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6399   -9.7491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6399  -11.7194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6240  -11.1523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6082  -11.7194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5923  -11.1523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5764  -11.7194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6240  -10.3159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6082   -9.7491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5923  -10.3159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5764   -9.7491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5742  -11.2037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5522  -10.3127    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5764   -8.8756    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2210  -10.7236    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0572  -12.1500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3013  -12.2141    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1255  -10.6556    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1052  -10.6675    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9658  -12.1945    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3882  -12.2455    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2429  -10.8534    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3809  -11.7349    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3036  -10.7350    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0695  -10.6771    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8972   -8.8142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8926   -8.8762    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  4  5  1  0  0  0  0
  1  5  1  0  0  0  0
  6  4  1  0  0  0  0
  3  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 10 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 15 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  2  0  0  0  0
 12 23  1  0     0  0
 13 24  1  0     0  0
 13 25  1  0     0  0
 14 26  1  0     0  0
 14 27  1  0     0  0
 15 28  1  0     0  0
 15 29  1  0     0  0
 20 30  1  0     0  0
 20 31  1  0     0  0
 20 32  1  0     0  0
 12 33  1  0     0  0
  4 34  1  0     0  0
  5 35  1  0     0  0
M  ISO  8  23   2  24   2  25   2  26   2  27   2  28   2  29   2  30   2
M  ISO  3  31   2  32   2  33   2
M  END
> <LM_ID>
LMFA03050035

> <COMMON_NAME>
(+/-)8,9-DiHETrE-d11

> <SYSTEMATIC_NAME>
(+/-)8,9-dihydroxy-5Z,11Z,14Z-eicosatrienoic-16,16,17,17,18,18,19,19,20,20,20-d11

> <FORMULA>
C20H23D11O4

> <MASS>
349.31

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Hydroxy/hydroperoxyeicosatrienoic acids [FA0305]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
8,9-DiHET-d11

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
10009998

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA03050035

$$$$