LMPK12113040
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0  0  0  0  0  0  0  0999 V2000
    7.8331    8.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8331    7.8677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7033    7.3654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5735    7.8677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5735    8.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7033    9.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4437    7.3654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3138    7.8677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3138    8.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4437    9.3748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4437    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1840    9.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0707    8.8628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9575    9.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9575   10.3989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0707   10.9109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1840   10.3989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1840    7.3654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9631    9.3748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7033    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8277    8.8724    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0707   11.9157    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9631    7.3654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8277   10.9013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.8864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4503   10.5419    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
  8 18  1  0  0  0  0
  1 19  1  0  0  0  0
  3 20  1  0  0  0  0
 14 21  1  0  0  0  0
 16 22  1  0  0  0  0
 15 24  1  0  0  0  0
  2 23  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113040

> <COMMON_NAME>


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

> <FORMULA>
C17H14O9

> <MASS>
362.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FYTXEZMPJUVWOR-UHFFFAOYSA-N

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

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44259885

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 46152

> <CITATION>
-

$$$$