LMPK12010110
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0     0  0            999 V2000
    7.5575    8.7421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5575    7.7890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3831    7.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2084    7.7890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2084    8.7421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3831    9.2187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0340    7.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8593    7.7890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8593    8.7421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0340    9.2187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6844    9.2185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5207    8.7357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3569    9.2185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3569   10.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5207   10.6670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6844   10.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5776    7.3989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.2185    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3831    6.3598    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1917   10.6661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0603    8.8123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3038    6.3860    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2895    4.3843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5518    3.4003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7002    5.9037    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9977    3.4277    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5718    6.4004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4349    5.8940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4264    4.8907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5576    4.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6946    4.9052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8257    4.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  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
  8 17  1  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 14 20  1  0  0  0  0
 13 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
 27 17  1  1     0  0
 28 22  1  6     0  0
 29 23  1  1     0  0
 30 24  1  6     0  0
M  CHG  1  10   1
M  END
> <LM_ID>
LMPK12010110

> <COMMON_NAME>
Chrysanthemin

> <SYSTEMATIC_NAME>
Cyanidin 3-O-glucoside

> <FORMULA>
C21H21O11

> <MASS>
449.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C08604

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
28426

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL7AACGL0001

> <PUBCHEM_COMPOUND_ID>
441667

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12010110

$$$$