LMPK12113108
  LIPID_MAPS_STRUCTURE_DATABASE

 45 49  0     0  0            999 V2000
    7.6159   12.4670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6159   11.4466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4994   10.9366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3829   11.4466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3829   12.4670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4994   12.9771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2665   10.9366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1500   11.4466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1500   12.4670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2665   12.9771    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2665   10.1411    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0333   12.9768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9339   12.4569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8343   12.9768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8343   14.0168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9339   14.5367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0333   14.0168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   12.9768    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7761   10.8291    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4994    9.9167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8412   14.5979    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4893   13.6374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2785   14.0929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5308    9.8156    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5163    7.7793    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7486    6.7782    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8822    9.3250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1676    6.8063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7689    9.8303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6469    9.3150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6383    8.2944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7545    7.7941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8765    8.3093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9926    7.8087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2407   11.7238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2485   12.0632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.5413   10.4961    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1838    9.2007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7884    8.9343    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5321    9.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8871   10.9403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8937   11.1091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5401   10.3255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1850    9.3715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8315    8.5878    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  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
  1 18  1  0  0  0  0
  8 19  1  0  0  0  0
  3 20  1  0  0  0  0
 21 15  1  0  0  0  0
  6 22  1  0  0  0  0
 22 23  1  0  0  0  0
 28 34  1  0     0  0
 33 27  1  0     0  0
 27 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  1     0  0
 30 24  1  6     0  0
 31 25  1  1     0  0
 32 26  1  6     0  0
 39 45  1  0     0  0
 44 38  1  0     0  0
 38 40  1  0     0  0
 40 41  1  0     0  0
 41 42  1  0     0  0
 42 43  1  0     0  0
 43 44  1  0     0  0
 44 45  1  1     0  0
 40 24  1  1     0  0
 41 35  1  6     0  0
 42 36  1  1     0  0
 43 37  1  6     0  0
 29 19  1  1     0  0
M  END
> <LM_ID>
LMPK12113108

> <COMMON_NAME>
Sexangularetin 3-sophoroside

> <SYSTEMATIC_NAME>


> <FORMULA>
C28H32O17

> <MASS>
640.16

> <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>
FL5FFAGL0005

> <PUBCHEM_COMPOUND_ID>
14017570

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12113108

$$$$