LMPK12112310
  LIPID_MAPS_STRUCTURE_DATABASE

 34 36  0  0  0  0  0  0  0  0999 V2000
    8.0320    7.3077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0320    6.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7663    6.0357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5007    6.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5007    7.3077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7663    7.7317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2350    6.0357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9694    6.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9694    7.3077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2350    7.7317    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2350    5.3746    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7034    7.7314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4519    7.2994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2002    7.7314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2002    8.5957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4519    9.0278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7034    8.5957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7663    5.1881    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7891    5.9737    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5316    5.9737    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6877    5.9814    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.6877    6.6276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6877    5.2636    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2979    7.7314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9400    8.9684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.7705    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4530    7.7784    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.4530    8.4244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4530    7.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0489    7.4983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7913    7.4983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9474    7.5061    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.9474    8.1523    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9474    6.7883    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
  8 19  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  2  0  0  0  0
 20 21  1  0  0  0  0
 19 21  1  0  0  0  0
  1 24  1  0  0  0  0
 15 25  1  0  0  0  0
 27 28  2  0  0  0  0
 27 29  2  0  0  0  0
 26 27  1  0  0  0  0
 24 27  1  0  0  0  0
 32 33  2  0  0  0  0
 32 34  2  0  0  0  0
 31 32  1  0  0  0  0
 30 32  1  0  0  0  0
 30 14  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112310

> <COMMON_NAME>
Quercetin 3,7,3'-tri-O-sulfate

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H10O16S3

> <MASS>
541.91

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C03897

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
16557

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL5FACNSS007

> <PUBCHEM_COMPOUND_ID>
5280631

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12112310

$$$$