LMPK12120205
  LIPID_MAPS_STRUCTURE_DATABASE

 23 24  0  0  0  0  0  0  0  0999 V2000
    5.9075    7.4751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9075    6.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6219    6.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3364    6.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3364    7.4751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6219    7.8876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0509    6.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0509    5.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7653    6.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4798    6.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1943    6.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9087    6.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6232    6.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6232    7.4751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9087    7.8876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1943    7.4751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0509    7.8876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.8876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4798    7.8876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6219    5.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9075    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.7126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4798    8.7126    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
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 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
  5 17  1  0  0  0  0
  1 18  1  0  0  0  0
 16 19  1  0  0  0  0
  3 20  1  0  0  0  0
 20 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120205

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
2'-Hydroxy-2,4',6'-trimethoxychalcone

> <FORMULA>
C18H18O5

> <MASS>
314.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KKTYCZKXENFEJP-CMDGGOBGSA-N

> <INCHI>
InChI=1S/C18H18O5/c1-21-13-10-15(20)18(17(11-13)23-3)14(19)9-8-12-6-4-5-7-16(12)22-2/h4-11,20H,1-3H3/b9-8+

> <SMILES>
C1(OC)C=C(O)C(C(/C=C/C2C(OC)=CC=CC=2)=O)=C(OC)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
637261

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$