LMGP10010948
  LIPID_MAPS_STRUCTURE_DATABASE

 55 54  0  0  0  0  0  0  0  0999 V2000
   21.1795    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4695    7.6072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7592    7.1984    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.0492    7.6072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0492    8.4280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.5900    6.4883    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.7691    6.4883    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3391    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8898    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6000    7.1984    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.3581    7.1813    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.6105    7.4857    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   23.2487    6.8586    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.6105    8.2334    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.0252    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0252    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3151    6.4789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5991    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8833    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1676    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4519    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7361    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0204    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3046    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5889    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8732    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1574    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4417    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7259    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0102    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2944    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5787    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8630    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1472    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4315    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7157    6.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6239    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9081    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1924    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4767    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7609    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0452    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3294    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6137    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8980    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1822    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4665    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7507    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0350    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3193    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6035    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8878    7.1984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1720    7.6085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4563    7.1984    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
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  1  7  1  6  0  0  0
  1  6  1  1  0  0  0
  9  1  1  0  0  0  0
 10  9  1  0  0  0  0
 12 11  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 15  7  1  0  0  0  0
 12 10  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
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
  8 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
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 44 45  1  0  0  0  0
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 46 47  1  0  0  0  0
 47 48  1  0  0  0  0
 48 49  1  0  0  0  0
 49 50  1  0  0  0  0
 50 51  1  0  0  0  0
 51 52  1  0  0  0  0
 52 53  1  0  0  0  0
 53 54  1  0  0  0  0
 54 55  1  0  0  0  0
M  END
> <LM_ID>
LMGP10010948

> <COMMON_NAME>
PA 20:0/22:0

> <SYSTEMATIC_NAME>
1-eicosanoyl-2-docosanoyl-glycero-3-phosphate

> <FORMULA>
C45H89O8P

> <MASS>
788.63

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphates [GP10]

> <SUB_CLASS>
Diacylglycerophosphates [GP1001]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
PA(42:0); PA(20:0_22:0)

> <INCHI_KEY>
URIYDEYHGMHXGX-VZUYHUTRSA-N

> <INCHI>
InChI=1S/C45H89O8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-45(47)53-43(42-52-54(48,49)50)41-51-44(46)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h43H,3-42H2,1-2H3,(H2,48,49,50)/t43-/m1/s1

> <SMILES>
[C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCC)=O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0115082

> <CHEBI_ID>
185702

> <ABBREVIATION>
PA 42:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000025954

> <PUBCHEM_COMPOUND_ID>
52929536

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$