LMPK12110847
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0  0  0  0  0  0  0  0999 V2000
    9.3867    7.7541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3867    8.7756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5021    9.2865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6172    8.7756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6172    7.7541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5021    7.2433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2715    7.2433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1562    7.7541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1562    8.7758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2715    9.2865    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0408    9.2867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9256    8.7758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8104    9.2867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8104   10.3082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9256   10.8190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0408   10.3082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2715    6.3605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6176   10.7743    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7325    9.2865    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5021    6.3802    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9256   11.7144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6901    8.7788    0.0000 O   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
 14 18  1  0  0  0  0
  4 19  1  0  0  0  0
  6 20  1  0  0  0  0
 15 21  1  0  0  0  0
 13 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110847

> <COMMON_NAME>
Tricetin

> <SYSTEMATIC_NAME>
5,7,3',4',5'-Pentahydroxyflavone

> <FORMULA>
C15H10O7

> <MASS>
302.04

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ARSRJFRKVXALTF-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H10O7/c16-7-3-8(17)14-9(18)5-12(22-13(14)4-7)6-1-10(19)15(21)11(20)2-6/h1-5,16-17,19-21H

> <SMILES>
C12C(=O)C=C(C3C=C(O)C(O)=C(O)C=3)OC=1C=C(O)C=C2O

> <KEGG_ID>
C10192

> <HMDB_ID>
HMDB0029620

> <CHEBI_ID>
507499

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5281701

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 34317

> <CITATION>
-

$$$$