LMGP01020075
  LIPID_MAPS_STRUCTURE_DATABASE

 40 39  0  0  0  0  0  0  0  0999 V2000
   17.8815    7.1998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1710    7.6089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4602    7.1998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2923    6.4892    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.4708    6.4892    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.5923    7.6102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3030    7.1998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.0623    7.1828    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.7730    6.7723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4838    7.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1945    6.7723    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   23.9053    7.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1945    5.9516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9053    6.3621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3141    7.4873    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   19.9521    6.8598    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   20.3141    8.2356    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.7264    6.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7264    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0158    6.4798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3000    6.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5838    6.4801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8675    6.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1513    6.4801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7437    7.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0274    7.2003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3112    7.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5950    7.2003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8788    7.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1625    7.2003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4462    7.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7300    7.2003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0137    7.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2975    7.2003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5812    7.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8650    7.2003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1488    7.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4325    7.2003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7163    7.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.2003    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
  1  5  1  6  0  0  0
  1  4  1  1  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 11 13  1  0  0  0  0
 11 14  1  0  0  0  0
 15  8  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 18  5  1  0  0  0  0
 15  7  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
  3 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
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  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
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
M  CHG  2  11   1  16  -1
M  END
> <LM_ID>
LMGP01020075

> <COMMON_NAME>
PC O-16:0/6:0

> <SYSTEMATIC_NAME>
1-hexadecyl-2-hexanoyl-sn-glycero-3-phosphocholine

> <FORMULA>
C30H62NO7P

> <MASS>
579.43

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphocholines [GP01]

> <SUB_CLASS>
1-alkyl,2-acylglycerophosphocholines [GP0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
PC(O-22:0); PC(O-16:0/6:0)

> <INCHI_KEY>
VTCXGJHVXXXOKR-GDLZYMKVSA-N

> <INCHI>
InChI=1S/C30H62NO7P/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-22-25-35-27-29(38-30(32)23-21-9-7-2)28-37-39(33,34)36-26-24-31(3,4)5/h29H,6-28H2,1-5H3/t29-/m1/s1

> <SMILES>
[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCC)=O)COCCCCCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
184216

> <ABBREVIATION>
PC O-22:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000028173

> <PUBCHEM_COMPOUND_ID>
24779312

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$