LMPK12111492
  LIPID_MAPS_STRUCTURE_DATABASE

 30 32  0  0  0  0  0  0  0  0999 V2000
    6.6487    7.4411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6487    6.6965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2935    6.3242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9384    6.6965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9384    7.4411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2935    7.8134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5832    6.3242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2280    6.6965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2280    7.4411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5832    7.8134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5832    5.5796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8728    7.8134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5299    7.4340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1871    7.8134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1871    8.5723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5299    8.9518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8728    8.5723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2935    8.5580    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0038    6.3242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.9037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2935    5.5796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2896    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5299    9.6964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5337   10.2760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8320    7.4411    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8320    6.2820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8320    8.9446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8359    8.3650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0038    7.8134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0038    8.9725    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
  6 18  1  0  0  0  0
  2 19  1  0  0  0  0
  3 21  1  0  0  0  0
 16 23  1  0  0  0  0
 14 25  1  0  0  0  0
 15 27  1  0  0  0  0
  1 29  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111492

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
8-Hydroxy-5,6,7,3',4',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>
OQDRNXWYFPDFEO-UHFFFAOYSA-N

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

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15224755

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$