LMPK12110505
  LIPID_MAPS_STRUCTURE_DATABASE

 45 49  0  0  0  0  0  0  0  0999 V2000
   10.3573   11.1901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3573   10.3715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0662    9.9623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7752   10.3715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7752   11.1901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0662   11.5995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4842    9.9623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1931   10.3715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1931   11.1901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4842   11.5995    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0662    9.1438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6484   11.5994    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9074   11.6286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5814   11.2396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2553   11.6286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2553   12.4067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5814   12.7959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9074   12.4067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9291   12.7959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5498   10.4017    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.0493    9.5868    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.7064    9.9812    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.5475    9.8233    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.9694   10.4542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2595   10.1125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.8002   10.4673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1126    9.1501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1844    9.1533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5814   13.5739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1844    8.0799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6515    7.6125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1824    7.7331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4842    9.1397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1324    6.7312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5335    6.3903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8737    6.7713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2139    6.3903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2139    5.6284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8737    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5335    5.6284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.2478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9690   10.7343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4005   10.8950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5051    6.7996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5051    8.0741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 44 45  1  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  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
  3 11  1  0  0  0  0
  1 12  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
  9 13  1  0  0  0  0
 16 19  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 23 22  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  1  0  0  0  0
 23  2  1  0  0  0  0
 17 29  1  0  0  0  0
 28 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
  7 33  2  0  0  0  0
 32 34  2  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 37  1  0  0  0  0
 37 38  2  0  0  0  0
 38 39  1  0  0  0  0
 39 40  2  0  0  0  0
 40 35  1  0  0  0  0
 38 41  1  0  0  0  0
 25 42  1  0  0  0  0
 37 44  1  0  0  0  0
 42 43  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110505

> <COMMON_NAME>
Isoorientin 2''-O-(E)-ferulate

> <SYSTEMATIC_NAME>


> <FORMULA>
C31H28O14

> <MASS>
624.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
trans-Feruloyl-2''-isoorientin

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL3FACCS0037

> <PUBCHEM_COMPOUND_ID>
44257942

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMPK12110505

$$$$