LMPK12050129
  LIPID_MAPS_STRUCTURE_DATABASE

 42 46  0     0  0            999 V2000
   10.5698   10.2240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5115    9.6802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4531   10.2240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3943    9.6806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3943    8.5532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3707    7.9897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3468    8.5532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3468    9.6806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3707   10.2441    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5119    8.5936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4531    8.0503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3707    6.8633    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3222    7.9901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3222    6.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2556    6.3737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1887    6.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1887    7.9901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2556    8.5290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4531   11.3107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1444    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9639    6.8338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6036    8.4725    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6020    8.4725    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6056   10.2031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1029   11.0726    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6220   11.7574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6058   10.2044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1055    9.3379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1021    9.3391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6041   10.2045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1045   11.0711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6064   11.9365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3298    7.4595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3155    5.4579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5778    4.4738    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7261    6.9772    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5979    7.4740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4609    6.9675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4524    5.9642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5836    5.4724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7205    5.9787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8517    5.4868    0.0000 C   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
  3 19  1  0  0  0  0
 16 20  1  0  0  0  0
 20 21  1  0  0  0  0
 26 32  1  0     0  0
 31 25  1  0     0  0
 25 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  1     0  0
 28 22  1  6     0  0
 29 23  1  1     0  0
 30 24  1  6     0  0
 41 36  1  0     0  0
 36 37  1  0     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  6     0  0
 37 22  1  1     0  0
 38 33  1  6     0  0
 39 34  1  6     0  0
 40 35  1  1     0  0
 27  1  1  1     0  0
M  END
> <LM_ID>
LMPK12050129

> <COMMON_NAME>
Retusin 7-O-neohesperidoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C28H32O14

> <MASS>
592.18

> <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>
FLIA3AGS0001

> <PUBCHEM_COMPOUND_ID>
101428180

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12050129

$$$$