LMGP02050048
  LIPID_MAPS_STRUCTURE_DATABASE

 35 34  0  0  0  0            999 V2000
   26.2787   -8.4507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.6036   -8.8404    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   24.9285   -8.4507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.9539   -8.8404    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.2534   -8.8404    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.0768   -9.6200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.6289   -8.4507    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   27.2392   -7.7755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.0187   -9.1258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.3041   -8.0609    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.9792   -8.4507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.6543   -8.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3294   -8.4507    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.1914   -9.6497    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.3623  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.6479   -9.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9334  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2189   -9.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5044  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7899   -9.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0755  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3610   -9.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6465  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9321   -9.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2175  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5031  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7886   -9.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0741  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3597  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6452   -9.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9307  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2163  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5017   -9.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7873  -10.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3623  -10.8575    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  2  6  1  6  0  0  0
  7  4  1  0  0  0  0
  8  7  2  0  0  0  0
  9  7  1  0  0  0  0
 10  7  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
  2 14  1  1  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  2  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  2  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  2  0  0  0  0
 33 32  1  0  0  0  0
 34 33  1  0  0  0  0
 15 35  2  0  0  0  0
 15  6  1  0  0  0  0
M  END
> <LM_ID>
LMGP02050048

> <COMMON_NAME>
PE 0:0/20:3(11Z,14Z,17Z)

> <SYSTEMATIC_NAME>
2-(11Z,14Z,17Z-eicosatrienoyl)-sn-glycero-3-phosphoethanolamine

> <FORMULA>
C25H46NO7P

> <MASS>
503.30

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphoethanolamines [GP02]

> <SUB_CLASS>
Monoacylglycerophosphoethanolamines [GP0205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
LPE(20:3)

> <INCHI_KEY>
OQKGGFIWKFEWBV-WCABUCBOSA-N

> <INCHI>
InChI=1S/C25H46NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)33-24(22-27)23-32-34(29,30)31-21-20-26/h3-4,6-7,9-10,24,27H,2,5,8,11-23,26H2,1H3,(H,29,30)/b4-3-,7-6-,10-9-/t24-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0011484

> <CHEBI_ID>
183045

> <ABBREVIATION>
LPE 20:3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000043293

> <PUBCHEM_COMPOUND_ID>
53480933

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$