LMPK12113341
  LIPID_MAPS_STRUCTURE_DATABASE

 29 31  0  0  0  0  0  0  0  0999 V2000
    7.0996    8.9485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0998    8.0192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9046    7.5544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7095    8.0193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7095    8.9485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9046    9.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5146    7.5546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3193    8.0193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3192    8.9486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5142    9.4133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5146    6.6251    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1241    9.4133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9445    8.9398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7647    9.4136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7646   10.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9443   10.8342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1241   10.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9046    6.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9443   11.7637    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5697   10.8254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6034   10.2285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2946    9.4132    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2946   10.8601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9046   10.3427    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1576   11.0662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2948    7.5544    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2948    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1243    7.5546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3774    8.2781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
 24 25  1  0  0  0  0
 26 27  1  0  0  0  0
 28 29  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
 16 19  1  0  0  0  0
  1 22  1  0  0  0  0
  6 24  1  0  0  0  0
  2 26  1  0  0  0  0
  8 28  1  0  0  0  0
 15 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113341

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,3'-Dihydroxy-3,6,7,8,4'-pentamethoxyflavone

> <FORMULA>
C20H20O9

> <MASS>
404.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GVLMRDDSMVCWKB-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H20O9/c1-24-11-7-6-9(8-10(11)21)15-17(25-2)13(22)12-14(23)18(26-3)20(28-5)19(27-4)16(12)29-15/h6-8,21,23H,1-5H3

> <SMILES>
C1(OC)=C(OC)C2OC(C3C=C(O)C(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>
369954

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 71047

> <CITATION>
-

$$$$