LMPK12110623
  LIPID_MAPS_STRUCTURE_DATABASE

 30 32  0  0  0  0  0  0  0  0999 V2000
    8.0590    9.0196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0590    8.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8406    7.6658    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
    8.8406    9.4709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4038    7.6658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1854    8.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1854    9.0196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4038    9.4709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4038    6.7632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9672    9.4709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7637    9.0111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5604    9.4709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5604   10.3908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7639   10.8508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9672   10.3908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3419   10.8420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2774    9.4709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2774   10.8760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2774    7.6658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    8.3683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7639   11.7533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9806   12.4559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9672    7.6658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9672    6.2608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3419    9.0196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3419    7.6146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8406    6.7632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6238    6.0607    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
  3 29  1  0  0  0  0
 16 23  1  0  0  0  0
  1 19  1  0  0  0  0
  2 21  1  0  0  0  0
 14 27  1  0  0  0  0
  8 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110623

> <COMMON_NAME>


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

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

> <SMILES>
C1(OC)=CC2OC(C3C=C(OC)C(O)=C(OC)C=3)=C(OC)C(=O)C=2C(OC)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258049

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 43711

> <CITATION>
-

$$$$