LMPK12010280
  LIPID_MAPS_STRUCTURE_DATABASE

 44 48  0     0  0            999 V2000
    7.6457   12.4208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6457   11.3662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5590   10.8388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4726   11.3662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4726   12.4208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5590   12.9482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3860   10.8388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2994   11.3662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2994   12.4208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3860   12.9482    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2125   12.9480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1434   12.4105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0744   12.9480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0744   14.0230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1434   14.5603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2125   14.0230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   12.9480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0051   14.5602    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5590    9.7845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9841   10.5932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1434   15.6351    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0051   12.4106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9408    6.5339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7914    9.8337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9552    7.9595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4165    6.8849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3979    9.1517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1696    9.6939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0219    9.2964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1029    8.3568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3334    7.8197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4811    8.2171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7117    7.6798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0107   11.2660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8610   10.9261    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.4883    9.1571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0321    8.7774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2093    7.7232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7147    9.6654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3243   10.3816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2515   10.2098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5650    9.3255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9554    8.6092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2690    7.7248    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  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
 13 22  1  0  0  0  0
 32 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  0     0  0
 32 33  1  1     0  0
 29 24  1  6     0  0
 30 25  1  1     0  0
 31 26  1  6     0  0
 38 44  1  0     0  0
 43 37  1  0     0  0
 37 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 24  1  1     0  0
 40 34  1  6     0  0
 41 35  1  1     0  0
 42 36  1  6     0  0
 23 33  1  0     0  0
 28 20  1  1     0  0
M  CHG  1  10   1
M  END
> <LM_ID>
LMPK12010280

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
Delphinidin 3-sophoroside

> <FORMULA>
C27H31O17

> <MASS>
627.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C16307

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
80439

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL7AAGGL0004

> <PUBCHEM_COMPOUND_ID>
23724705

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12010280

$$$$