LMGP20010005
  LIPID_MAPS_STRUCTURE_DATABASE

 42 41  0     0  0            999 V2000
   21.6618    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8005    9.2277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9388    8.7318    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.0774    9.2277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0774   10.2236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.1599    7.8705    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1639    7.8705    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2161    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5235    9.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3851    8.7318    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.5179    8.7111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.3794    8.2136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.2411    8.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.1026    8.2136    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   28.9643    8.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.1026    7.2188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.9643    7.7163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.6109    9.0803    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   24.1720    8.3197    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.6109    9.9874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.2614    7.3614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2614    6.3651    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.4001    7.8589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5312    7.3614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6631    7.8588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3483    9.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4801    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6117    9.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7435    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8751    9.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0069    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1385    9.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2702    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4021    9.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5337    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6655    9.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7971    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9289    9.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7947    7.3614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7947    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9281    7.8616    0.0000 H   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 14  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 18 11  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 21  7  1  0  0  0  0
 18 10  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 40  1  0  0  0  0
  8 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
 40 41  2  0  0  0  0
 40 42  1  0  0  0  0
M  CHG  2  14   1  19  -1
M  END
> <LM_ID>
LMGP20010005

> <COMMON_NAME>
PC 16:0/5:0;5oxo

> <SYSTEMATIC_NAME>
1-hexadecanoyl-2-(5-oxovaleroyl)-sn-glycero-3-phosphocholine

> <FORMULA>
C29H56NO9P

> <MASS>
593.37

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Oxidized glycerophospholipids [GP20]

> <SUB_CLASS>
Oxidized glycerophosphocholines [GP2001]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1-Palmitoyl-2-(5-oxovaleroyl)-sn-glycero-3-phosphorylcholine; POVPC;  PC(16:0/5:0(CHO))

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
77890

> <CAYMAN_ID>
10031

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
23557187

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMGP20010005

$$$$