LMGP02050074
  LIPID_MAPS_STRUCTURE_DATABASE

 30 29  0     0  0            999 V2000
   19.9342    7.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0723    7.7188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2101    7.2227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3483    7.7188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3483    8.7152    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.4324    6.3607    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.4359    6.3607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4864    7.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7964    7.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6585    7.2227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.7926    7.2019    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.6547    6.7041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.5169    7.2019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.3789    6.7041    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.8851    7.5714    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   22.4459    6.8102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.8851    8.4790    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6177    7.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7489    7.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8801    7.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0112    7.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1425    7.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2736    7.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4048    7.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5360    7.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6672    7.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7983    7.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9296    7.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    7.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9296    8.7204    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  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0     0  0
M  END
> <LM_ID>
LMGP02050074

> <COMMON_NAME>
PE 14:0(13Me)/0:0

> <SYSTEMATIC_NAME>
1-(13-methyl-tetradecanoyl)-sn-glycero-3-phosphoethanolamine

> <FORMULA>
C20H42NO7P

> <MASS>
439.27

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphoethanolamines [GP02]

> <SUB_CLASS>
Monoacylglycerophosphoethanolamines [GP0205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
LPE(15:0)

> <INCHI_KEY>
OTLGIBROBHTAHD-LJQANCHMSA-N

> <INCHI>
InChI=1S/C20H42NO7P/c1-18(2)12-10-8-6-4-3-5-7-9-11-13-20(23)26-16-19(22)17-28-29(24,25)27-15-14-21/h18-19,22H,3-17,21H2,1-2H3,(H,24,25)/t19-/m1/s1

> <SMILES>
[C@](COP(=O)(O)OCCN)([H])(O)COC(CCCCCCCCCCCC(C)C)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
LPE 15:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000030114

> <PUBCHEM_COMPOUND_ID>
171120945

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1898398

> <CITATION>
34500631

$$$$