LMFA03100002
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0  0  0  0  0  0  0  0999 V2000
    6.4384    6.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1580    6.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8776    6.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5971    6.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3168    6.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0363    6.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7559    6.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4754    6.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1950    6.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5971    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4384    7.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7183    6.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7183    7.7402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7183    8.5710    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1592    7.7394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8794    7.3239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7103    7.3239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4310    7.7390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1513    7.3234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8715    7.7390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5917    7.3234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3120    7.7390    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5917    6.6309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7181    5.2547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  1  0  0  0
  2  3  2  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  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  4 10  1  6  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
 11 15  1  6  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 12 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
 12 25  2  0  0  0  0
M  END
> <LM_ID>
LMFA03100002

> <COMMON_NAME>
LGD2

> <SYSTEMATIC_NAME>
(8R,12R)-9,10-seco-9,11-dioxo-15S-hydroxy-5Z,13E-prostadienoic acid

> <FORMULA>
C20H32O5

> <MASS>
352.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Levuglandins [FA0310]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Levuglandin D2

> <INCHI_KEY>
MLLWPVVMXGUOHD-QNUMDXCLSA-N

> <INCHI>
InChI=1S/C20H32O5/c1-3-4-7-11-18(23)13-14-19(16(2)22)17(15-21)10-8-5-6-9-12-20(24)25/h5,8,13-15,17-19,23H,3-4,6-7,9-12H2,1-2H3,(H,24,25)/b8-5-,14-13+/t17-,18-,19-/m0/s1

> <SMILES>
[C@H](C(=O)C)([C@@H](C/C=C\CCCC(=O)O)C=O)/C=C/[C@@H](O)CCCCC

> <KEGG_ID>
C13808

> <HMDB_ID>
HMDB0002400

> <CHEBI_ID>
34820

> <ABBREVIATION>
FA 20:4;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9548876

> <LIPIDBANK_ID>
-

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

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

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Oxo fatty acids [FA0106]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$