LMPK12112176
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0     0  0            999 V2000
   10.3449   10.9180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3449    9.9118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2162    9.4087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0876    9.9118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0876   10.9180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2162   11.4209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9588    9.4087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8302    9.9118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8302   10.9180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9588   11.4209    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9588    8.6243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7011   11.4208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5891   10.9080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4772   11.4208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4772   12.4462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5891   12.9588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7011   12.4462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4739   11.4208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2162    8.4030    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2358   13.0992    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7011    9.4089    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5891   13.9839    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2020    6.4016    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4614    5.4131    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7403    6.4260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4825    8.4153    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9870    7.7856    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3485    7.9087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3414    6.9081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4683    6.4138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6079    6.9203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6150    7.9209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7545    8.4274    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  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
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 20 15  1  0  0  0  0
  8 21  1  0  0  0  0
 16 22  1  0  0  0  0
 27 33  1  0     0  0
 32 26  1  0     0  0
 26 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
 28 19  1  1     0  0
 29 23  1  6     0  0
 30 24  1  1     0  0
 31 25  1  6     0  0
M  END
> <LM_ID>
LMPK12112176

> <COMMON_NAME>
Quercetin 5-glucoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C21H20O12

> <MASS>
464.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QJTYCCFDQWFJHU-HMGRVEAOSA-N

> <INCHI>
InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)32-12-5-8(23)4-11-14(12)16(27)18(29)20(31-11)7-1-2-9(24)10(25)3-7/h1-5,13,15,17,19,21-26,28-30H,6H2/t13-,15-,17+,19-,21-/m1/s1

> <SMILES>
C1(O)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O)C(=O)C=2C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
52946987

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$