LMFA02000021
  LIPID_MAPS_STRUCTURE_DATABASE

 23 22  0  0  0  0  0  0  0  0999 V2000
   17.9656    6.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7223    5.8696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.9656    7.0065    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2031    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4405    6.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6777    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9151    6.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1524    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3896    6.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6270    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8642    6.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1016    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3388    6.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5762    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8135    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0507    6.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2880    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5253    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7627    6.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8642    6.9286    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1016    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3388    6.9286    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  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  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 11 21  1  1  0  0  0
 12 22  1  6  0  0  0
 13 23  1  1  0  0  0
M  END
> <LM_ID>
LMFA02000021

> <COMMON_NAME>
9S,10S,11R-trihydroxy-12Z,15Z-octadecadienoic acid

> <SYSTEMATIC_NAME>
9S,10S,11R-trihydroxy-12Z,15Z-octadecadienoic acid

> <FORMULA>
C18H32O5

> <MASS>
328.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KFINXCASWPGHEW-YQFBSDGMSA-N

> <INCHI>
InChI=1S/C18H32O5/c1-2-3-4-6-9-12-15(19)18(23)16(20)13-10-7-5-8-11-14-17(21)22/h3-4,9,12,15-16,18-20,23H,2,5-8,10-11,13-14H2,1H3,(H,21,22)/b4-3-,12-9-/t15-,16+,18-/m1/s1

> <SMILES>
C(CCCCCCC[C@H](O)[C@H](O)[C@H](O)/C=C\C/C=C\CC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
183609

> <ABBREVIATION>
FA 18:2;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
16061055

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$