LMGP20020054
  LIPID_MAPS_STRUCTURE_DATABASE

 36 35  0     0  0            999 V2000
   24.6622   -6.2010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8377   -6.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0132   -6.2010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4867   -6.6769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.1887   -6.6769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.2444   -7.6291    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.3111   -6.2010    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   25.8353   -5.3764    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.7872   -7.0255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.1357   -5.7249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.9601   -6.2010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.7847   -5.7249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.6092   -6.2010    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   24.5555   -7.6653    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.8087   -8.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8038   -8.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8087  -10.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8038  -10.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1864   -9.5498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6655   -9.1018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5273   -8.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6655   -9.9972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5273  -10.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5224   -8.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5224  -10.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3845   -9.1018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2461   -8.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1080   -9.1018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9699   -8.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8316   -9.1018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.3845   -9.9972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2461  -10.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1080   -9.9972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9699  -10.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8316   -9.9972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1050  -11.1984    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  3  2  1  0     0  0
  4  1  1  0     0  0
  5  3  1  0     0  0
  2  6  1  6     0  0
  7  4  1  0     0  0
  8  7  2  0     0  0
  9  7  1  0     0  0
 10  7  1  0     0  0
 11 10  1  0     0  0
 12 11  1  0     0  0
 13 12  1  0     0  0
  2 14  1  1     0  0
 15 16  2  0     0  0
 17 18  1  0     0  0
 15 19  1  0     0  0
 19 17  1  0     0  0
 20 16  1  0     0  0
 21 20  1  0     0  0
 22 18  2  0     0  0
 23 22  1  0     0  0
 21 24  2  0     0  0
 23 25  2  0     0  0
 26 24  1  0     0  0
 27 26  1  0     0  0
 28 27  1  0     0  0
 29 28  1  0     0  0
 30 29  2  0     0  0
 31 25  1  0     0  0
 32 31  1  0     0  0
 33 32  1  0     0  0
 34 33  1  0     0  0
 35 34  1  0     0  0
 17 36  1  6     0  0
 29  6  1  0     0  0
M  END
> <LM_ID>
LMGP20020054

> <COMMON_NAME>
PE 0:0/20:4;O)

> <SYSTEMATIC_NAME>
2-(11R-hydroxy-5Z,8Z,12E,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine

> <FORMULA>
C25H44NO8P

> <MASS>
517.28

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Oxidized glycerophospholipids [GP20]

> <SUB_CLASS>
Oxidized glycerophosphoethanolamines [GP2002]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
11R-HETE-LPE

> <INCHI_KEY>
YYNINOSNLIMLAJ-XQSHPIDZSA-N

> <INCHI>
InChI=1S/C25H44NO8P/c1-2-3-4-5-7-10-13-16-23(28)17-14-11-8-6-9-12-15-18-25(29)34-24(21-27)22-33-35(30,31)32-20-19-26/h6-7,9-11,13-14,16,23-24,27-28H,2-5,8,12,15,17-22,26H2,1H3,(H,30,31)/b9-6-,10-7-,14-11-,16-13+/t23-,24+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
137580

> <ABBREVIATION>
LPE 20:4;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
129626686

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Glycerophospholipids [GP]

> <ALT_MAIN_CLASSES>
Glycerophosphoethanolamines [GP02]

> <ALT_SUB_CLASSES>
Monoacylglycerophosphoethanolamines [GP0205]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
27642067

$$$$