LMGP10010050
  LIPID_MAPS_STRUCTURE_DATABASE

 42 41  0  0  0  0  0  0  0  0999 V2000
   17.6822    7.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9676    7.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2527    7.2110    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5381    7.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5381    8.4485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0953    6.4963    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.2691    6.4963    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8235    7.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3971    7.6237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1119    7.2110    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.8814    7.1938    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1289    7.5001    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   19.7648    6.8690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1289    8.2527    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5204    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5204    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8058    6.4868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0851    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3648    6.4867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6444    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9240    6.4867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2037    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4833    6.4867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7629    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0426    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3222    6.4867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6018    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8815    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1611    6.4867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4407    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7204    6.4867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1036    7.6237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3833    7.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6629    7.6237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9425    7.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2222    7.6237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5018    7.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7814    7.6237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0611    7.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3407    7.6237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6203    7.2110    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
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 15  7  1  0  0  0  0
 12 10  1  0  0  0  0
 17 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  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  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
  8 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
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
M  END
> <LM_ID>
LMGP10010050

> <COMMON_NAME>
PA 12:0/17:2(9Z,12Z)

> <SYSTEMATIC_NAME>
1-dodecanoyl-2-(9Z,12Z-heptadecadienoyl)-glycero-3-phosphate

> <FORMULA>
C32H59O8P

> <MASS>
602.39

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphates [GP10]

> <SUB_CLASS>
Diacylglycerophosphates [GP1001]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
PA(29:2); PA(12:0_17:2)

> <INCHI_KEY>
YPZSTAAQNZFGRR-YRGPPRKWSA-N

> <INCHI>
InChI=1S/C32H59O8P/c1-3-5-7-9-11-13-14-15-16-17-19-21-23-25-27-32(34)40-30(29-39-41(35,36)37)28-38-31(33)26-24-22-20-18-12-10-8-6-4-2/h9,11,14-15,30H,3-8,10,12-13,16-29H2,1-2H3,(H2,35,36,37)/b11-9-,15-14-/t30-/m1/s1

> <SMILES>
[C@](COP(=O)(O)O)([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)COC(CCCCCCCCCCC)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187265

> <ABBREVIATION>
PA 29:2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
52928643

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$