LMPK12113339
  LIPID_MAPS_STRUCTURE_DATABASE

 28 30  0  0  0  0  0  0  0  0999 V2000
    5.8671    7.4148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8673    6.6365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5413    6.2473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2154    6.6366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2154    7.4148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5413    7.8040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8896    6.2474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5636    6.6366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5635    7.4149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8894    7.8041    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8896    5.4690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2376    7.8041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9246    7.4074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6117    7.8041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6116    8.5975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9244    8.9941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2376    8.5973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2377    6.2474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5413    5.4690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9244    9.7724    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5413    8.5823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5907    9.1883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2856    8.9867    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1514    8.4868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1932    6.2473    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1932    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.8040    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    9.0158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 25 26  1  0  0  0  0
 27 28  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
  8 18  1  0  0  0  0
  3 19  1  0  0  0  0
 16 20  1  0  0  0  0
  2 25  1  0  0  0  0
  1 27  1  0  0  0  0
  6 21  1  0  0  0  0
 15 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113339

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3,5,3'-Trihydroxy-6,7,8,4'-tetramethoxyflavone

> <FORMULA>
C19H18O9

> <MASS>
390.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MSJSUAMCRPCVFM-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H18O9/c1-24-10-6-5-8(7-9(10)20)15-14(23)12(21)11-13(22)17(25-2)19(27-4)18(26-3)16(11)28-15/h5-7,20,22-23H,1-4H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10000451

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$