LMGP20010020
  LIPID_MAPS_STRUCTURE_DATABASE

 50 49  0     0  0            999 V2000
    4.1298    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2726    1.0485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4150    0.5548    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5577    1.0485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5577    2.0395    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8655   -0.5425    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3943   -0.5425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7003    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9875    1.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8450    0.5548    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9678    0.5342    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8252    0.0391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6828    0.5342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5403    0.0391    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3979    0.5342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5403   -0.9751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3979   -0.4560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0650    0.9018    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    6.6282    0.1446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0650    1.8046    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4961   -1.0493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4961   -1.9207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6387   -0.5539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7741   -1.0493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0902   -0.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9543   -1.0493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8185   -0.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6827   -1.0493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5469   -0.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4111   -1.0493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2753   -0.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1395   -1.0493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0037   -0.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4111   -2.0395    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8678   -1.0493    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0037    0.1061    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1633    1.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0276    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8917    1.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7559    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6202    1.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4843    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3486    1.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2127    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0768    1.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9411    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8052    1.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6695    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5337    1.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3979    0.5548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  4  8  1  0     0  0
  1  7  1  6     0  0
  1  6  1  1     0  0
  9  1  1  0     0  0
 10  9  1  0     0  0
 12 11  1  0     0  0
 13 12  1  0     0  0
 14 13  1  0     0  0
 15 14  1  0     0  0
 14 16  1  0     0  0
 14 17  1  0     0  0
 18 11  1  0     0  0
 18 19  1  0     0  0
 18 20  2  0     0  0
 21 22  2  0     0  0
 21 23  1  0     0  0
 21  7  1  0     0  0
 18 10  1  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  2  0     0  0
 32 33  1  0     0  0
 30 34  1  0     0  0
 33 35  1  0     0  0
 33 36  2  0     0  0
  8 37  1  0     0  0
 37 38  1  0     0  0
 38 39  1  0     0  0
 39 40  1  0     0  0
 40 41  1  0     0  0
 41 42  1  0     0  0
 42 43  1  0     0  0
 43 44  1  0     0  0
 44 45  1  0     0  0
 45 46  1  0     0  0
 46 47  1  0     0  0
 47 48  1  0     0  0
 48 49  1  0     0  0
 49 50  1  0     0  0
M  CHG  2  14   1  19  -1
M  END
> <LM_ID>
LMGP20010020

> <COMMON_NAME>
PHODA-PC

> <SYSTEMATIC_NAME>
1-hexadecanoyl-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine

> <FORMULA>
C36H68NO10P

> <MASS>
705.46

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Oxidized glycerophospholipids [GP20]

> <SUB_CLASS>
Oxidized glycerophosphocholines [GP2001]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1-palmitoyl-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
134812292

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMGP20010020

$$$$