LMPK12111490
  LIPID_MAPS_STRUCTURE_DATABASE

 30 32  0  0  0  0  0  0  0  0999 V2000
    8.0591    9.0196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0591    8.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8408    7.6657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6223    8.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6223    9.0196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8408    9.4708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4039    7.6657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1855    8.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1855    9.0196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4039    9.4708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4039    6.7632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9671    9.4708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7638    9.0110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5603    9.4708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5603   10.3907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7638   10.8507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9671   10.3907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3420   10.8420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2775    7.6657    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.3682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3420    9.0196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3420    7.6146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7638   11.7533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9805   12.4558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8408    6.7632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6240    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2775    9.4708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2775   10.8758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8408   10.3734    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0575   11.0759    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
 15 18  1  0  0  0  0
 16 23  1  0  0  0  0
  3 25  1  0  0  0  0
  1 27  1  0  0  0  0
  6 29  1  0  0  0  0
  2 19  1  0  0  0  0
 14 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111490

> <COMMON_NAME>


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

> <FORMULA>
C21H22O9

> <MASS>
418.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FBAFEXJDBWVSTQ-UHFFFAOYSA-N

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

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258653

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 102775

> <CITATION>
-

$$$$