LMPK12050237
  LIPID_MAPS_STRUCTURE_DATABASE

 38 41  0     0  0            999 V2000
   10.7667   10.0444    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6675    9.5243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5684   10.0444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4690    9.5245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4690    8.4460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4031    7.9067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3370    8.4460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3370    9.5245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4031   10.0637    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6679    8.4845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5684    7.9646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4031    6.8290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2704    7.9072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2704    6.8761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1633    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0563    6.8761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0563    7.9072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1633    8.4227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5517    6.9270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9490    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1119   11.5269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0048   11.0114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8978   11.5269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7908   11.0114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8978   12.5580    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1119   12.5580    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9490    8.4227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7525    8.0430    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0119    7.0546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2908    8.0674    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0330   10.0567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8991    9.5501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8920    8.5495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0189    8.0552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1584    8.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1655    9.5623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3050   10.0688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2228   11.0654    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
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  4  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11  5  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 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 13  1  0  0  0  0
 11 19  1  0  0  0  0
 16 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
 21 26  2  0  0  0  0
 17 27  1  0  0  0  0
 36 31  1  0     0  0
 31 32  1  0     0  0
 32 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  1     0  0
 32  1  1  1     0  0
 33 28  1  6     0  0
 34 29  1  1     0  0
 35 30  1  6     0  0
 37 38  1  0     0  0
 38 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050237

> <COMMON_NAME>
Orobol 7-O-(6''-malonylglucoside)

> <SYSTEMATIC_NAME>


> <FORMULA>
C24H22O14

> <MASS>
534.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FLIAACGS0003

> <PUBCHEM_COMPOUND_ID>
102463143

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMPK12050237

$$$$