LMPK12010140
  LIPID_MAPS_STRUCTURE_DATABASE

 44 48  0     0  0            999 V2000
    7.6084   12.2455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6084   11.2339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844   10.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3604   11.2339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3604   12.2455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844   12.7514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2364   10.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1126   11.2339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1126   12.2455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2364   12.7514    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9884   12.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8813   12.2356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7740   12.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7740   13.7820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8813   14.2978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9884   13.7820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327   12.7510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6668   14.2976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844    9.7169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8944   10.7945    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8813   15.3285    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8671    6.4724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3913    5.5643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9641    6.4740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4769    5.4673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3649    5.4673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8849    4.6357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9250    4.6357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4450    5.4673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9250    6.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8849    6.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4858    5.4673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4455    7.1292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8239   10.2628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3282    8.3257    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9044    6.9254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4338    9.1231    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1472    9.8285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1119    9.5627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3634    8.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6515    7.8914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6868    8.1572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9749    7.4571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9910    7.6357    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  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 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 11  1  0  0  0  0
  1 17  1  0  0  0  0
 14 18  1  0  0  0  0
  3 19  1  0  0  0  0
 20  8  1  0  0  0  0
 15 21  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
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 26  1  0  0  0  0
 29 32  1  0  0  0  0
 30 33  1  0  0  0  0
 42 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  0     0  0
 42 43  1  1     0  0
 38 20  1  1     0  0
 39 34  1  6     0  0
 40 35  1  1     0  0
 41 36  1  6     0  0
 43 44  1  0     0  0
 44 22  1  0  0  0  0
M  CHG  1  10   1
M  END
> <LM_ID>
LMPK12010140

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
Cyanidin 3-(6''-caffeylglucoside)

> <FORMULA>
C30H27O14

> <MASS>
611.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C16369

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
80476

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL7AACGL0031

> <PUBCHEM_COMPOUND_ID>
23724734

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12010140

$$$$