LMPK12113039
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0  0  0  0  0  0  0  0999 V2000
    6.3096    7.2512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3101    6.4536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0014    6.0553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6919    6.4547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6912    7.2524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0001    7.6508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3831    6.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0736    6.4560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0730    7.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3817    7.6519    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3838    5.2587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7636    7.6530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4680    7.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1719    7.6540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1713    8.4671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4668    8.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7630    8.4662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6183    7.6495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0019    5.2576    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8619    8.8665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8631    7.2556    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4662    9.6708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5123    6.4536    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.5663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2133    5.6705    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3810    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 23 24  1  0  0  0  0
 25 26  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
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 15 20  1  0  0  0  0
 14 21  1  0  0  0  0
 16 22  1  0  0  0  0
  2 23  1  0  0  0  0
  8 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113039

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,7,3',4',5'-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>
ZUBFWGOFMRYWNS-UHFFFAOYSA-N

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

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44259884

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$