LMPK12111580
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    7.8771    6.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8771    7.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1575    7.7401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4379    7.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4379    6.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1575    6.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5966    6.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3161    6.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3160    7.3249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5966    7.7401    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0356    7.7403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7551    7.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4747    7.7404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4747    8.5713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7551    8.9868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0355    8.5713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5966    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7184    7.7401    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0357    6.0784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1942    8.9868    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7551    9.6644    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1931    7.3257    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9114    7.7405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7541    6.4932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.3254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  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  2  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  4 18  1  0  0  0  0
  8 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 19 24  1  0  0  0  0
 18 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111580

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
4',5'-Dihydroxy-3,7,3'-trimethoxyflavone

> <FORMULA>
C18H16O7

> <MASS>
344.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CXNYWXODOUUFAW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H16O7/c1-22-10-4-5-11-13(8-10)25-17(18(24-3)15(11)20)9-6-12(19)16(21)14(7-9)23-2/h4-8,19,21H,1-3H3

> <SMILES>
C12C(=O)C(OC)=C(C3C=C(O)C(O)=C(OC)C=3)OC=1C=C(OC)C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10593524

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$