LMPK12112595
  LIPID_MAPS_STRUCTURE_DATABASE

 23 25  0  0  0  0  0  0  0  0999 V2000
    5.8813    7.2044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8813    6.4098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5694    6.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2576    6.4098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2576    7.2044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5694    7.6017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9457    6.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6339    6.4098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6339    7.2044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9457    7.6017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9457    5.2178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3220    7.6017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0233    7.1969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7246    7.6017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7246    8.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0233    8.8166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3220    8.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3220    6.0125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5694    5.2178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4129    8.8089    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2966    8.2987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.6017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.8386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  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
  8 18  1  0  0  0  0
  3 19  1  0  0  0  0
 15 20  1  0  0  0  0
  1 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112595

> <COMMON_NAME>
Kaempferol 7,4'-dimethyl ether

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

> <FORMULA>
C17H14O6

> <MASS>
314.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KZBAXKKOXPLOBX-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O6/c1-21-10-5-3-9(4-6-10)17-16(20)15(19)14-12(18)7-11(22-2)8-13(14)23-17/h3-8,18,20H,1-2H3

> <SMILES>
C1(OC)=CC2OC(C3C=CC(OC)=CC=3)=C(O)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
146145

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5378823

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$