LMPK03000053
  LIPID_MAPS_STRUCTURE_DATABASE

 43 44  0     0  0            999 V2000
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  -10.9704   -0.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2291   -0.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8333   -0.8880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6874   -0.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8245   -0.9840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9617   -0.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0988   -0.9840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2359   -0.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3730   -0.9840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4898   -0.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3527   -0.9840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2156   -0.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5503   -0.9840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7273   -0.3402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3706   -0.8855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5120   -0.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6535   -0.8855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7950   -0.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1476   -0.9905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4959   -1.9187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4862   -1.8744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7501   -0.9189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9228   -0.3726    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5985   -0.8133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.7022   -1.7991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.6718   -2.0052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1674   -1.1468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5040   -0.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0749   -2.9109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.7102    0.5596    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8463   -1.8792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2021    0.5054    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3706   -1.8769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3730   -1.9753    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2359    0.5055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4088   -0.4883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2673   -0.9840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1258   -0.4882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9843   -0.9839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8428   -0.4882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7014   -0.9839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5598   -0.4882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  1  3  1  0     0  0
  2  4  1  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
  5 14  1  0     0  0
  4 15  1  0     0  0
  3 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 23 24  1  6     0  0
 19 23  1  0     0  0
 13 20  1  0     0  0
 15 25  1  0     0  0
 25 26  2  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 25  1  0     0  0
 27 30  1  6     0  0
 29 31  2  0     0  0
  4 32  1  6     0  0
 13 33  1  6     0  0
 16 34  1  0     0  0
 10 35  1  1     0  0
  9 36  1  1     0  0
 14 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
 20 24  1  1     0  0
M  END
> <LM_ID>
LMPK03000053

> <COMMON_NAME>
Tucupentol

> <SYSTEMATIC_NAME>


> <FORMULA>
C35H64O8

> <MASS>
612.46

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Annonaceae acetogenins [PK03]

> <SUB_CLASS>
-

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171121279

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK03000053

$$$$