LMPK12110873
  LIPID_MAPS_STRUCTURE_DATABASE

 24 26  0  0  0  0  0  0  0  0999 V2000
    7.7518    6.1539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7518    6.9997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0193    7.4226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2868    6.9997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2869    6.1539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0193    5.7310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844    5.7310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2168    6.1539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2168    6.9997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844    7.4226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9493    7.4226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6818    6.9997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4142    7.4226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4142    8.2684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6817    8.6913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9493    8.2684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0826    8.6544    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.4226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0193    5.0163    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6817    9.4326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1425    7.0021    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8701    7.4222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0408    9.8027    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
  1  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  2  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 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 11  1  0  0  0  0
  7 17  2  0  0  0  0
 14 18  1  0  0  0  0
  4 19  1  0  0  0  0
  6 20  1  0  0  0  0
 15 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 21 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110873

> <COMMON_NAME>
Tricin

> <SYSTEMATIC_NAME>
5,7,4'-Trihydroxy-3',5'-dimethoxyflavone

> <FORMULA>
C17H14O7

> <MASS>
330.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HRGUSFBJBOKSML-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)17(14)21)12-7-11(20)16-10(19)5-9(18)6-13(16)24-12/h3-7,18-19,21H,1-2H3

> <SMILES>
C12C(=O)C=C(C3C=C(OC)C(O)=C(OC)C=3)OC=1C=C(O)C=C2O

> <KEGG_ID>
C10193

> <HMDB_ID>
HMDB0124861

> <CHEBI_ID>
59979

> <ABBREVIATION>
-

> <CAYMAN_ID>
35835

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5281702

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$