LMPK12113281
  LIPID_MAPS_STRUCTURE_DATABASE

 30 32  0  0  0  0  0  0  0  0999 V2000
    7.8584    6.2377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8584    7.0628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1438    7.4754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4292    7.0628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4292    6.2377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1438    5.8251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5731    5.8252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2877    6.2379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2874    7.0631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5730    7.4754    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0020    7.4757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7166    7.0633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4310    7.4760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4310    8.3011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7164    8.7137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0019    8.3010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5731    5.0001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7146    7.4754    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0022    5.8253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1456    8.7137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1438    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7164    9.5388    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0022    5.0002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.0628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1444    7.0641    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1438    8.3005    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8566    7.4754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8602    8.3011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0019    9.9514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4292    8.7131    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
 14 20  1  0  0  0  0
  6 21  1  0  0  0  0
 15 22  1  0  0  0  0
 19 23  1  0  0  0  0
 18 24  1  0  0  0  0
 13 25  1  0  0  0  0
  3 26  1  0  0  0  0
 25 27  1  0  0  0  0
 20 28  1  0  0  0  0
 22 29  1  0  0  0  0
 26 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113281

> <COMMON_NAME>


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

> <FORMULA>
C21H22O9

> <MASS>
418.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YBWGYGWOYCKNFB-UHFFFAOYSA-N

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

> <SMILES>
C12C(=O)C(OC)=C(C3C=C(OC)C(OC)=C(OC)C=3)OC=1C(OC)=C(OC)C=C2O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15382686

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$