LMPK12113328
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0  0  0  0  0  0  0  0999 V2000
    9.5605   -6.7110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5662   -7.6779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4067   -8.1562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2412   -7.6676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2352   -6.7008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3949   -6.2224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0815   -8.1461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9160   -7.6574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9100   -6.6905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0696   -6.2122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0873   -9.1130    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7445   -6.2019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6010   -6.6897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4517   -6.1919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4456   -5.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5891   -4.7186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7387   -5.2165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7201   -6.2326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3891   -5.2554    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4125   -9.1233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5833   -3.7517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2802   -4.7177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7032   -8.1832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8342   -7.6884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7851   -8.1521    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7913   -9.1521    0.0000 C   0  0  0  0  0  0  0  0  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
  1 18  1  0  0  0  0
  6 19  1  0  0  0  0
  3 20  1  0  0  0  0
 16 21  1  0  0  0  0
 15 22  1  0  0  0  0
  2 23  1  0     0  0
 23 24  1  0     0  0
  8 25  1  0     0  0
 25 26  1  0     0  0
M  END
> <LM_ID>
LMPK12113328

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,7,8,3',4'-Pentahydroxy-3,6-dimethoxyflavone

> <FORMULA>
C17H14O9

> <MASS>
362.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
UDKMHQFJYPBQRT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O9/c1-24-16-10(20)9-11(21)17(25-2)14(26-15(9)12(22)13(16)23)6-3-4-7(18)8(19)5-6/h3-5,18-20,22-23H,1-2H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21676156

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 71047

> <CITATION>
-

$$$$