LMPK12111841
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0     0  0            999 V2000
    7.5790    8.8040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5790    7.8265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4255    7.3376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2721    7.8265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2721    8.8040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4255    9.2928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1186    7.3376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9652    7.8265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9652    8.8040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1186    9.2928    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1186    6.5756    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8114    9.2925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6743    8.7945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5371    9.2925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5371   10.2888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6743   10.7870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8114   10.2888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    9.2925    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4255    6.3605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9515    6.9892    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3995   10.7869    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5828    5.8296    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3941    3.8368    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5773    3.0079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9471    5.5761    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8587    5.9949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6743    5.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5785    4.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6701    4.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8545    4.5819    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  8  1  0  0  0  0
 15 21  1  0  0  0  0
 30 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 26 20  1  1     0  0
 27 22  1  6     0  0
 28 23  1  1     0  0
 29 24  1  6     0  0
M  END
> <LM_ID>
LMPK12111841

> <COMMON_NAME>
Kaempferol 3-xyloside

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H18O10

> <MASS>
418.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RNVUDWOQYYWXBJ-BWYUNELBSA-N

> <INCHI>
InChI=1S/C20H18O10/c21-9-3-1-8(2-4-9)18-19(30-20-17(27)15(25)12(24)7-28-20)16(26)14-11(23)5-10(22)6-13(14)29-18/h1-6,12,15,17,20-25,27H,7H2/t12-,15+,17-,20+/m1/s1

> <SMILES>
C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
76294

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21310440

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$