LMGP02050043
  LIPID_MAPS_STRUCTURE_DATABASE

 33 32  0  0  0  0            999 V2000
   25.9644   -8.7257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.2893   -9.1155    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   24.6142   -8.7257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6396   -9.1155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.9390   -9.1155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.7625   -9.8951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.3146   -8.7257    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   26.9249   -8.0505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.7044   -9.4008    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.9898   -8.3359    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.6649   -8.7257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.3400   -8.3359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.0151   -8.7257    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   25.8771   -9.9248    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9019  -10.3076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6164   -9.8950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3309  -10.3076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0453  -10.3075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7598   -9.8950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4743  -10.3075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1888  -10.3076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9033   -9.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6178  -10.3076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3322  -10.3075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0467   -9.8950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7612  -10.3075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4757   -9.8950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1902  -10.3075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9046   -9.8950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6191  -10.3075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3336   -9.8950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0480  -10.3075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0480  -11.1326    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  2  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  2  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  2  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 33 32  2  0  0  0  0
  6 32  1  0  0  0  0
M  END
> <LM_ID>
LMGP02050043

> <COMMON_NAME>
PE 0:0/18:3(9Z,12Z,15Z)

> <SYSTEMATIC_NAME>
2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine

> <FORMULA>
C23H42NO7P

> <MASS>
475.27

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphoethanolamines [GP02]

> <SUB_CLASS>
Monoacylglycerophosphoethanolamines [GP0205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
LPE(18:3)

> <INCHI_KEY>
JGWWMNVPHKMUCV-WOBXFXBNSA-N

> <INCHI>
InChI=1S/C23H42NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)31-22(20-25)21-30-32(27,28)29-19-18-24/h3-4,6-7,9-10,22,25H,2,5,8,11-21,24H2,1H3,(H,27,28)/b4-3-,7-6-,10-9-/t22-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0011479

> <CHEBI_ID>
145259

> <ABBREVIATION>
LPE 18:3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000043339

> <PUBCHEM_COMPOUND_ID>
53480928

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$