LMPK12110859
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0     0  0            999 V2000
   12.8502    8.4286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8502    7.4451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6394    6.9895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4285    7.4451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4285    8.3565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6394    8.8121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2178    6.9895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0070    7.4451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0070    8.3565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2178    8.8121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2178    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8114    8.8208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6158    8.3565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4201    8.8208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4201    9.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6158   10.2139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8114    9.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6394    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0456    8.9321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.2245   10.2139    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.6158   11.1427    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.2245    8.3565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2088   11.4851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2245    7.6194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0314    6.9308    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2908    5.9423    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5697    6.9552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3119    8.9444    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1779    8.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1709    7.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2977    6.9429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4373    7.4494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4444    8.4500    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
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 20 15  1  0  0  0  0
 14 22  1  0  0  0  0
 16 21  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 33 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  0     0  0
 29 19  1  1     0  0
 30 25  1  6     0  0
 31 26  1  1     0  0
 32 27  1  6     0  0
M  END
> <LM_ID>
LMPK12110859

> <COMMON_NAME>
Tricin 7-xyloside

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H22O11

> <MASS>
462.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MJMGQZTXKNKYCG-HSYYIUIDSA-N

> <INCHI>
InChI=1S/C22H22O11/c1-29-16-3-9(4-17(30-2)20(16)27)14-7-12(24)18-11(23)5-10(6-15(18)33-14)32-22-21(28)19(26)13(25)8-31-22/h3-7,13,19,21-23,25-28H,8H2,1-2H3/t13-,19+,21-,22+/m1/s1

> <SMILES>
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)=CC2OC(C3C=C(OC)C(O)=C(OC)C=3)=CC(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
154623667

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$