LMGP10020068
  LIPID_MAPS_STRUCTURE_DATABASE

 54 53  0  0  0  0  0  0  0  0999 V2000
   21.2593    7.2081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5456    7.6189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8318    7.2081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.6717    6.4944    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.8467    6.4944    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.9730    7.6202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6867    7.2081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.4536    7.1909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.7023    7.4968    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   23.3387    6.8666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.7023    8.2482    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.0992    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0992    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3856    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6660    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9468    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2275    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5082    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7890    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0697    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3504    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6312    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9119    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1926    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4734    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7541    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0348    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3156    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5963    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8771    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1578    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4385    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7193    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.1658    7.6189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4465    7.2081    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
  1  5  1  6  0  0  0
  1  4  1  1  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  9  8  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
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M  END
> <LM_ID>
LMGP10020068

> <COMMON_NAME>
PA O-20:0/22:2(13Z,16Z)

> <SYSTEMATIC_NAME>
1-eicosyl-2-(13Z,16Z-docosadienoyl)-glycero-3-phosphate

> <FORMULA>
C45H87O7P

> <MASS>
770.62

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphates [GP10]

> <SUB_CLASS>
1-alkyl,2-acylglycerophosphates [GP1002]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
PA(O-42:2); PA(O-20:0/22:2)

> <INCHI_KEY>
HIBIKEUDUKDPHC-LFJRERBHSA-N

> <INCHI>
InChI=1S/C45H87O7P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-45(46)52-44(43-51-53(47,48)49)42-50-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,44H,3-10,12,14-16,18,20-43H2,1-2H3,(H2,47,48,49)/b13-11-,19-17-/t44-/m1/s1

> <SMILES>
[C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCC/C=C\C/C=C\CCCCC)=O)COCCCCCCCCCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
PA O-42:2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000045703

> <PUBCHEM_COMPOUND_ID>
52929631

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$