LMGP02050014
  LIPID_MAPS_STRUCTURE_DATABASE

 37 36  0  0  0  0  0  0  0  0999 V2000
   20.2732    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6410    6.2130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0086    5.8490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3766    6.2130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3766    6.9437    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.6386    5.2169    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.9078    5.2169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7445    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9055    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5378    5.8490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.1031    5.8338    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.7354    5.4687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3677    5.8338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0000    5.4687    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.4375    6.1048    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   22.1154    5.5465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.4375    6.7705    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1073    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4701    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8329    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1956    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5584    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9212    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2840    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6467    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0095    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3723    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7350    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0978    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4606    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8234    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1861    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5489    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9117    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2745    5.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6372    6.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8490    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
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 11  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 15 10  1  0  0  0  0
  8 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  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  2  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
M  END
> <LM_ID>
LMGP02050014

> <COMMON_NAME>
PE 22:4(7Z,10Z,13Z,16Z)/0:0

> <SYSTEMATIC_NAME>
1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-glycero-3-phosphoethanolamine

> <FORMULA>
C27H48NO7P

> <MASS>
529.32

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphoethanolamines [GP02]

> <SUB_CLASS>
Monoacylglycerophosphoethanolamines [GP0205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
LPE(22:4(7Z,10Z,13Z,16Z)/0:0); LPE(22:4)

> <INCHI_KEY>
NJHKGJJIKOCCMZ-YMIVKDKMSA-N

> <INCHI>
InChI=1S/C27H48NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27(30)33-24-26(29)25-35-36(31,32)34-23-22-28/h6-7,9-10,12-13,15-16,26,29H,2-5,8,11,14,17-25,28H2,1H3,(H,31,32)/b7-6-,10-9-,13-12-,16-15-/t26-/m1/s1

> <SMILES>
[C@](COP(=O)(O)OCCN)([H])(O)COC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0011523

> <CHEBI_ID>
145290

> <ABBREVIATION>
LPE 22:4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000030146

> <PUBCHEM_COMPOUND_ID>
52925133

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
19717841

$$$$