LMPK12111570
  LIPID_MAPS_STRUCTURE_DATABASE

 24 26  0  0  0  0  0  0  0  0999 V2000
    8.3334   -8.0566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3334   -8.9924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1439   -9.4603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9543   -8.9924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9543   -8.0566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1439   -7.5887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7647   -9.4603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5750   -8.9924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5750   -8.0566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7646   -7.5889    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7647  -10.3961    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3854   -7.5887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2112   -8.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0372   -7.5887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0372   -6.6350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2112   -6.1582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3854   -6.6350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3854   -9.4603    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5229   -7.5887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2112   -5.2223    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8475   -6.1671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5228   -6.5887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0773   -4.7223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7135   -6.6671    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
 16 20  1  0  0  0  0
 15 21  1  0  0  0  0
 19 22  1  0     0  0
 20 23  1  0     0  0
 21 24  1  0     0  0
M  END
> <LM_ID>
LMPK12111570

> <COMMON_NAME>
Fisetin 7,3',4'-trimethyl ether

> <SYSTEMATIC_NAME>
3-Hydroxy-7,3',4'-trimethoxyflavone

> <FORMULA>
C18H16O6

> <MASS>
328.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KSAJVJYHNOORPX-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H16O6/c1-21-11-5-6-12-14(9-11)24-18(17(20)16(12)19)10-4-7-13(22-2)15(8-10)23-3/h4-9,20H,1-3H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
265724

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 162936

> <CITATION>
-

$$$$