LMFA12000325
  LIPID_MAPS_STRUCTURE_DATABASE

 22 22  0     0  0            999 V2000
   -0.4386   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3224   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2066   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0908   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9749   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8591   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7432   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6274   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5116   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3957   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2799   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1641   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0482   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9324   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8165   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.7007   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5849   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4690   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.3532   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.2374   -0.2533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.1215   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7220    0.5123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  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
 15 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
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 11 22  1  1     0  0
 12 22  1  6     0  0
M  END
> <LM_ID>
LMFA12000325

> <COMMON_NAME>
Posticlure

> <SYSTEMATIC_NAME>
trans-11S,12S-Epoxy-6Z,9Z-heneicosadiene

> <FORMULA>
C21H38O

> <MASS>
306.29

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AZNAATMZDDJQSS-SCMRAZOXSA-N

> <INCHI>
InChI=1S/C21H38O/c1-3-5-7-9-11-13-15-17-19-21-20(22-21)18-16-14-12-10-8-6-4-2/h11,13,17,19-21H,3-10,12,14-16,18H2,1-2H3/b13-11-,19-17-/t20-,21-/m0/s1

> <SMILES>
CCCCC/C=C\C/C=C\[C@@H]1O[C@H]1CCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10494907

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
335471

> <CITATION>
-

$$$$