LMPK12113221
  LIPID_MAPS_STRUCTURE_DATABASE

 39 42  0     0  0            999 V2000
    8.2569    9.2071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2569    8.1765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1494    7.6612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0419    8.1765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0419    9.2071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1494    9.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9345    7.6612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8270    8.1765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8270    9.2071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9345    9.7224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9345    6.7074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9509    9.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8607    9.3955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7704    9.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7704   10.9711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8607   11.4962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9509   10.9711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1494    6.7275    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7439   11.5332    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1908    9.8225    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8607   12.5464    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8707    7.2434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8734    7.2434    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.8734    8.1511    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9174    7.2434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8734    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1537   10.6600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2242   11.1916    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7199   13.1288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1437   14.5291    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6142   12.3314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6519   14.9048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9008   11.6260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9361   11.8918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6846   12.8631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3965   13.5631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3612   13.2973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0732   13.9974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0571   13.8188    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  3 18  1  0  0  0  0
 19 15  1  0  0  0  0
  4  3  1  0  0  0  0
  1 20  1  0  0  0  0
 16 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 23 26  2  0  0  0  0
 25  8  1  0  0  0  0
 27  6  1  0  0  0  0
 32 38  1  0     0  0
 37 31  1  0     0  0
 31 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 37 38  1  1     0  0
 33 27  1  1     0  0
 34 28  1  6     0  0
 35 29  1  1     0  0
 36 30  1  6     0  0
 38 39  2  0     0  0
M  END
> <LM_ID>
LMPK12113221

> <COMMON_NAME>
Gossypetin 8-glucuronide-3-sulfate

> <SYSTEMATIC_NAME>


> <FORMULA>
C21H18O17S

> <MASS>
574.03

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL5FFCGSS002

> <PUBCHEM_COMPOUND_ID>
21722020

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMPK12113221

$$$$