LMGL01010036
  LIPID_MAPS_STRUCTURE_DATABASE

 28 27  0  0  0  0  0  0  0  0999 V2000
    2.0039    0.9447    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1286    1.4488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2528    0.9447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6226    1.4488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4982    0.9447    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7588    0.0691    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2532    0.0691    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1286   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1286   -1.4488    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0039    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8859   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7684    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6508   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5331   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4155    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2978   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1802    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0626   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9449    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8274    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7098   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5922    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4746    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3569   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.2393    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1216   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0040    0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.8865   -0.4366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  3  7  1  6     0  0
  3  6  1  1     0  0
  4  5  1  0     0  0
  7  8  1  0     0  0
  8  9  2  0     0  0
  8 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  2  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
 22 23  2  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
M  END
> <LM_ID>
LMGL01010036

> <COMMON_NAME>
Sciadonoyl-2-glycerol

> <SYSTEMATIC_NAME>
2-(5Z,11Z,14Z-eicosatrienoyl)-sn-glycerol

> <FORMULA>
C23H40O4

> <MASS>
380.29

> <CATEGORY>
Glycerolipids [GL]

> <MAIN_CLASS>
Monoradylglycerols [GL01]

> <SUB_CLASS>
Monoacylglycerols [GL0101]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
2-SG; MG 0:0/20:3(5Z,11Z,14Z)/0:0

> <INCHI_KEY>
KXAFDKQQSSWDNZ-URZBRJKDSA-N

> <INCHI>
InChI=1S/C23H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-22(20-24)21-25/h6-7,9-10,15-16,22,24-25H,2-5,8,11-14,17-21H2,1H3/b7-6-,10-9-,16-15-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
MG 20:3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101046553

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
31167809

$$$$