LMPK12112226
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0     0  0            999 V2000
   12.0528   13.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0528   12.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9394   11.7015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8262   12.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8262   13.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9394   13.7492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1661   11.7015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2793   12.2135    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3927   11.7015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3927   10.6778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2793   10.1658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1661   10.6778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5060   12.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6193   11.7015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6193   10.6778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5060   10.1658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2872    9.2826    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   12.2135    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0528   10.1658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5078    9.3193    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5608   13.6615    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6063   11.7631    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4288    8.6466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9068    6.7102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9784    6.1962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7852    8.8318    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7535    9.0928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4605    8.3857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1996    7.4174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2392    7.1644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5322    7.8714    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
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
  9 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 10  1  0  0  0  0
 14 18  1  0  0  0  0
 11 17  2  0  0  0  0
 12 19  1  0  0  0  0
 16 20  1  0  0  0  0
  5 21  1  0  0  0  0
  4 22  1  0  0  0  0
 26 31  1  0     0  0
 31 30  1  0     0  0
 30 29  1  0     0  0
 29 28  1  0     0  0
 28 27  1  0     0  0
 27 26  1  0     0  0
 28 23  1  1     0  0
 29 24  1  6     0  0
 30 25  1  6     0  0
 27 19  1  6     0  0
M  END
> <LM_ID>
LMPK12112226

> <COMMON_NAME>
Quercetin 3-O-alpha-D-arabinopyranoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H18O11

> <MASS>
434.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PZZRDJXEMZMZFD-KRLKJCFRSA-N

> <INCHI>
InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2/t12-,15-,17+,20-/m1/s1

> <SMILES>
C1C=C(O)C(O)=CC=1C1=C(O[C@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)C(=O)C2C(O)=CC(O)=CC=2O1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
141135

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12309865

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$