LMPK12120313
  LIPID_MAPS_STRUCTURE_DATABASE

 23 24  0  0  0  0  0  0  0  0999 V2000
    5.8804    7.4257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8804    6.6321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5677    6.2354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2549    6.6321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2549    7.4257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5677    7.8224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9421    6.2354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6293    6.6321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3163    6.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0033    6.6321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6964    6.2321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3894    6.6321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3894    7.4324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6964    7.8325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0033    7.4324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9421    5.6161    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5677    5.4421    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0822    7.8324    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9418    7.8223    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.8225    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    9.0579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0767    6.2354    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0767    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  1  0  0  0  0
 22 23  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 11  2  0  0  0  0
 11 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 10  1  0  0  0  0
  7 16  2  0  0  0  0
  3 17  1  0  0  0  0
 13 18  1  0  0  0  0
  5 19  1  0  0  0  0
 12 22  1  0  0  0  0
  1 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120313

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
4,2',6'-Trihydroxy-3,4'-dimethoxychalcone

> <FORMULA>
C17H16O6

> <MASS>
316.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
IBIYLFIHGWIFSB-GQCTYLIASA-N

> <INCHI>
InChI=1S/C17H16O6/c1-22-11-8-14(20)17(15(21)9-11)13(19)6-4-10-3-5-12(18)16(7-10)23-2/h3-9,18,20-21H,1-2H3/b6-4+

> <SMILES>
C1(OC)=CC(O)=C(C(=O)/C=C/C2C=CC(O)=C(OC)C=2)C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607626

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$