LMGL02010286
  LIPID_MAPS_STRUCTURE_DATABASE

 51 50  0  0  0  0  0  0  0  0999 V2000
   23.1243    7.2509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3916    7.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6586    7.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9260    7.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.4605    7.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4605    8.5197    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.0822    6.5180    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.2351    6.5180    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.5025    6.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5025    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.7698    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7277    7.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0316    6.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2931    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5546    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8161    6.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0776    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3391    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6006    6.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8621    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1236    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3851    6.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6466    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9080    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1695    6.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4310    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6925    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9540    6.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2155    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4770    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0000    6.5180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9895    7.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.3429    7.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.3889    7.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6504    7.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9119    7.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1734    7.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4349    7.6728    0.0000 C   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
  3  9  1  6  0  0  0
  3  8  1  1  0  0  0
  4  5  1  0  0  0  0
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  6  7  2  0  0  0  0
  6 13  1  0  0  0  0
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M  END
> <LM_ID>
LMGL02010286

> <COMMON_NAME>
DG 20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0 [iso2]

> <SYSTEMATIC_NAME>
1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol

> <FORMULA>
C45H66O5

> <MASS>
686.49

> <CATEGORY>
Glycerolipids [GL]

> <MAIN_CLASS>
Diradylglycerols [GL02]

> <SUB_CLASS>
Diacylglycerols [GL0201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
DG(20:5/22:6/0:0)[iso2]; DG(42:11); DG(20:5_22:6)

> <INCHI_KEY>
IYZLSPKVBGVQGT-KDMZTRHFSA-N

> <INCHI>
InChI=1S/C45H66O5/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-45(48)50-43(41-46)42-49-44(47)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,22,24-25,27-28,30-31,33-34,36,43,46H,3-4,9-10,15-16,21,23,26,29,32,35,37-42H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,24-22-,27-25-,30-28-,33-31-,36-34-/t43-/m0/s1

> <SMILES>
OC[C@]([H])(OC(CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0007585

> <CHEBI_ID>
170882

> <ABBREVIATION>
DG 42:11

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000124136

> <PUBCHEM_COMPOUND_ID>
9543951

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$