LMPK12113377
  LIPID_MAPS_STRUCTURE_DATABASE

 30 32  0  0  0  0  0  0  0  0999 V2000
    7.5568    8.3442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5658    7.4275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3641    6.9772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1534    7.4432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1443    8.3597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3461    8.8104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9516    6.9928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7408    7.4589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7318    8.3756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9335    8.8259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9605    6.0761    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5211    8.8415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3345    8.3824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1391    8.8573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1300    9.7915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3164   10.2507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5119    9.7757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3732    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9076    6.5575    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2524    6.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8877    9.6042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6013   10.8399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7630    8.8025    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7630   10.2294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0295    9.6145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4102    8.5006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7181   10.2341    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4824    9.5207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6492    7.4275    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.4080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 25 26  1  0  0  0  0
 27 28  1  0  0  0  0
 29 30  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
  3 18  1  0  0  0  0
  6 21  1  0  0  0  0
  1 23  1  0  0  0  0
 15 25  1  0  0  0  0
 17 27  1  0  0  0  0
  2 29  1  0  0  0  0
  8 19  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113377

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5-Hydroxy-3,6,7,8,2',4'-hexamethoxyflavone

> <FORMULA>
C21H22O9

> <MASS>
418.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PRQZCQXKEQGINA-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H22O9/c1-24-10-7-8-11(12(9-10)25-2)16-18(26-3)14(22)13-15(23)19(27-4)21(29-6)20(28-5)17(13)30-16/h7-9,23H,1-6H3

> <SMILES>
C1(OC)=C(OC)C2OC(C3C(OC)=CC(OC)=CC=3)=C(OC)C(=O)C=2C(O)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44260084

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 414627

> <CITATION>
-

$$$$