LMPK12112843
  LIPID_MAPS_STRUCTURE_DATABASE

 45 49  0     0  0            999 V2000
   11.5710    8.9299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5710    7.9019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4612    7.3882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3512    7.9019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3512    8.9299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4612    9.4439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2414    7.3882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1316    7.9019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1316    8.9299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2414    9.4439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2414    6.5866    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0214    9.4437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9287    8.9199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8360    9.4437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8360   10.4912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9287   11.0150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0214   10.4912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4612    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1059   11.0982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7791    9.4439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1138    7.3350    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8413   13.0346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3509   13.8838    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9590   13.0346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4235   13.8392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3519   13.8392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8236   13.0225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7667   13.0225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2382   13.8392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7667   14.6560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8236   14.6560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2375   15.4717    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1799   13.8392    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6812    7.3883    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7662    7.7177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7645    7.7320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7804    9.4697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2839   10.3213    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7806    9.4496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2742    8.5866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2709    8.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7790    9.4639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2854   10.3269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7934   11.1958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2206   12.1000    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  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
  3 18  1  0  0  0  0
 19 15  1  0  0  0  0
 20  1  1  0  0  0  0
 21  8  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
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 27 28  1  0  0  0  0
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 31 26  1  0  0  0  0
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 29 33  1  0  0  0  0
  2 34  1  0  0  0  0
 43 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  0     0  0
 42 43  1  0     0  0
 43 44  1  1     0  0
 39 20  1  1     0  0
 40 35  1  6     0  0
 41 36  1  1     0  0
 42 37  1  6     0  0
 44 45  1  0     0  0
 45 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112843

> <COMMON_NAME>
6-Hydroxykaempferol 7-(6''-(E)-caffeylglucoside)

> <SYSTEMATIC_NAME>


> <FORMULA>
C30H26O15

> <MASS>
626.13

> <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>
FL5FEAGS0017

> <PUBCHEM_COMPOUND_ID>
101773451

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12112843

$$$$