LMPK12060007
  LIPID_MAPS_STRUCTURE_DATABASE

 32 36  0     0  0            999 V2000
    8.1980   10.5607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1980    9.5608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0640    9.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9302    9.5608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9302   10.5607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0640   11.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7963    9.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6622    9.5608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6622   10.5607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7963   11.0611    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5283    9.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3943    9.5608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3943   10.5607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5283   11.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5283    8.0608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3943    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2605    8.0608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2605    9.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7963    8.0608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8024   12.0374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7927   12.0903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4304   11.1465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9268   12.5904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9268   13.5904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   12.0903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7927   13.0904    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6622   11.5608    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6622    8.5610    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.3943    6.5606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2603    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1266    7.5608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9926    8.0608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  9  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 12  1  0  0  0  0
  7 19  2  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22  1  1  0  0  0  0
 21 23  1  1  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
 21 26  1  6  0  0  0
  9 27  1  1  0  0  0
  8 28  1  1  0  0  0
 17 31  1  0  0  0  0
 16 29  1  0  0  0  0
 29 30  1  0  0  0  0
 31 32  1  0  0  0  0
M  END
> <LM_ID>
LMPK12060007

> <COMMON_NAME>
Rotenone

> <SYSTEMATIC_NAME>
(2R,6aS,12aS)-1,2,6,6a,12,12a- hexahydro-2-isopropenyl-8,9- dimethoxychromeno[3,4-b]furo(2,3-h)chromen-6-one

> <FORMULA>
C23H22O6

> <MASS>
394.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Rotenoid flavonoids [PK1206]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Tubotoxin

> <KEGG_ID>
C07593

> <HMDB_ID>
HMDB0034436

> <YMDB_ID>
-

> <CHEBI_ID>
28201

> <CAYMAN_ID>
13995

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FLIF1LNF0001

> <PUBCHEM_COMPOUND_ID>
6758

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://www.lipidmaps.org/databases/lmsd/LMPK12060007

$$$$