LMPK12112782
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0  0  0  0  0  0  0  0999 V2000
    7.6982    6.6497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6982    7.4748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9835    7.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2689    7.4747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2689    6.6496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9835    6.2371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4128    6.2371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1274    6.6497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1272    7.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4128    7.8874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8418    7.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5563    7.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2710    7.8877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2710    8.7128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5563    9.1254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8417    8.7128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4128    5.4120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.8873    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8419    6.2371    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9835    5.4120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9855    9.1254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5563    9.9505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8417   10.3631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9844    7.4758    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5553    6.6490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2701    5.0000    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
  4 18  1  0  0  0  0
  8 19  1  0  0  0  0
  6 20  1  0  0  0  0
 14 21  1  0  0  0  0
 15 22  1  0  0  0  0
 22 23  1  0  0  0  0
 13 24  1  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112782

> <COMMON_NAME>


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

> <FORMULA>
C18H16O8

> <MASS>
360.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ODRBLEJSVVCENJ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H16O8/c1-23-11-6-9(19)7-12-14(11)16(22)18(25-3)17(26-12)8-4-10(20)15(21)13(5-8)24-2/h4-7,19-21H,1-3H3

> <SMILES>
C12C(=O)C(OC)=C(C3C=C(OC)C(O)=C(O)C=3)OC=1C=C(O)C=C2OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44259711

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$