LMPK12112435
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0     0  0            999 V2000
    7.5697    8.7775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5697    7.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4070    7.3272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2444    7.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2444    8.7775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4070    9.2607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0818    7.3272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9192    7.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9192    8.7775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0818    9.2607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0818    6.5733    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7560    9.2606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6095    8.7680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4628    9.2606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4628   10.2462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6095   10.7388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7560   10.2462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.2606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8946    6.9823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3161   10.7387    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4070    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6095   11.7239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3161    8.7680    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7801    7.6535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3043    6.3559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9411    4.3922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4760    5.3490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6558    6.3361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5984    6.6716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3616    6.0202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1799    5.0385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2372    4.7029    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
 19  8  1  0  0  0  0
 15 20  1  0  0  0  0
  3 21  1  0  0  0  0
 16 22  1  0  0  0  0
 14 23  1  0  0  0  0
 32 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  0     0  0
 28 19  1  1     0  0
 29 24  1  6     0  0
 30 25  1  1     0  0
 31 26  1  6     0  0
M  END
> <LM_ID>
LMPK12112435

> <COMMON_NAME>
Myricetin 3-xyloside

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H18O12

> <MASS>
450.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SBEOEJNITMVWLK-CFSKSFDZSA-N

> <INCHI>
InChI=1S/C20H18O12/c21-7-3-8(22)13-12(4-7)31-18(6-1-9(23)14(26)10(24)2-6)19(16(13)28)32-20-17(29)15(27)11(25)5-30-20/h1-4,11,15,17,20-27,29H,5H2/t11-,15+,17-,20+/m1/s1

> <SMILES>
C1(O)=CC2OC(C3C=C(O)C(O)=C(O)C=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>
69458

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
23900088

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$