LMPK12110824
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0  0  0  0  0  0  0  0999 V2000
    6.2655    7.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2655    6.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9770    6.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6886    6.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6886    7.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9770    7.7109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4000    6.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1116    6.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1116    7.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4000    7.7109    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8226    7.7106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5765    7.2753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3306    7.7106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3306    8.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5765    9.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8226    8.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.7106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4000    5.2471    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0840    7.2756    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9770    5.4153    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0840    9.0162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6759    8.6744    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
  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
  1 17  1  0  0  0  0
  7 18  2  0  0  0  0
 13 19  1  0  0  0  0
  3 20  1  0  0  0  0
 14 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110824

> <COMMON_NAME>
Diosmetin

> <SYSTEMATIC_NAME>
5,7,3'-Trihydroxy-4'-methoxyflavone

> <FORMULA>
C16H12O6

> <MASS>
300.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
4'-Methylluteolin

> <INCHI_KEY>
MBNGWHIJMBWFHU-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3

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

> <KEGG_ID>
C10038

> <HMDB_ID>
HMDB0029676

> <CHEBI_ID>
4630

> <ABBREVIATION>
-

> <CAYMAN_ID>
18649

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5281612

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$