LMPK12113286
  LIPID_MAPS_STRUCTURE_DATABASE

 29 31  0  0  0  0  0  0  0  0999 V2000
    5.8465    6.8861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8465    6.1317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4999    5.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1534    6.1317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1534    6.8861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4999    7.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8067    5.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4600    6.1317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4600    6.8861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8067    7.2634    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8067    5.0001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1135    7.2633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7792    6.8788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4451    7.2633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4451    8.0323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7792    8.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1135    8.0323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4999    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4999    8.0177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.2634    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1136    5.7545    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1307    6.3416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0986    8.4094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1158    7.8223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7792    9.1712    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7963    9.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4600    8.4094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4600    9.5839    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
  6 19  1  0  0  0  0
  1 20  1  0  0  0  0
  8 22  1  0  0  0  0
 15 24  1  0  0  0  0
 16 26  1  0  0  0  0
 17 28  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113286

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,8-Dihydroxy-3,7,2',3',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>
AESOWAJOPILJJE-UHFFFAOYSA-N

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

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44260042

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$