LMPK03000035
  LIPID_MAPS_STRUCTURE_DATABASE

 45 47  0     0  0            999 V2000
    0.8146    4.9482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0474    5.4459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2737    3.2348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0103    5.0231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1478    5.5212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2851    5.0233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4224    5.5214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5597    5.0235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6972    5.5216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9716    5.5218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7606    4.9866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7870    4.7797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8788    5.5244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7472    5.0229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6157    5.5242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4839    5.0226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3524    5.5239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2208    5.0224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0000    4.3914    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8411    4.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5815    5.9061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5802    5.9586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6156    5.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4840    4.8884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3523    5.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2207    4.8884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0892    5.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9576    4.8884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4840    3.8857    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.0892    6.3926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.3170    3.9523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3183    4.0048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5779    4.9734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7368    5.5195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.6047    4.8634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7363    5.3647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.8679    4.8634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9995    5.3647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1310    4.8634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2626    5.3647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2648    6.3675    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8344    5.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8343    4.0208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2 14  1  0     0  0
  3  4  1  0     0  0
  4  1  1  0     0  0
  4  5  2  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
 12  1  1  0     0  0
 14  3  1  0     0  0
 14 13  1  1     0  0
  6 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  6     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 24 20  1  0     0  0
 26 25  1  0     0  0
 27 26  1  0     0  0
 28 27  1  0     0  0
 29 28  1  0     0  0
 30 29  1  0     0  0
 25 22  1  0     0  0
 26 31  1  6     0  0
 29 32  1  6     0  0
 30 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  6     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 35  1  0     0  0
 42 43  1  6     0  0
 22 21  1  1     0  0
 30 36  1  1     0  0
 44 12  1  0     0  0
 11 44  1  0     0  0
 44 45  1  0     0  0
M  END
> <LM_ID>
LMPK03000035

> <COMMON_NAME>
Annosquatin-II

> <SYSTEMATIC_NAME>


> <FORMULA>
C37H66O8

> <MASS>
638.48

> <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>
171119284

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/index.php/databases/lmsd/LMPK03000035

$$$$