LMPK12120346
  LIPID_MAPS_STRUCTURE_DATABASE

 23 25  0  0  0  0  0  0  0  0999 V2000
    6.2778    7.3231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2778    6.4926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9970    6.0774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7161    6.4926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7161    7.3231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9970    7.7383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4352    6.0774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1544    6.4926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8732    6.0777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5921    6.4926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3173    6.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0425    6.4926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0425    7.3300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3173    7.7487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5921    7.3300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4352    5.4294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9970    5.2474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4881    7.5797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.9078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4881    6.2360    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7676    7.7486    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4350    7.7380    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1541    7.3228    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 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
  1 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20  2  1  0  0  0  0
 13 21  1  0  0  0  0
  5 22  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120346

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
4,2'-Dihydroxy-6'-methoxy-3',4'-methylenedioxychalcone

> <FORMULA>
C17H14O6

> <MASS>
314.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FDKKYJDJQQWMEA-QPJJXVBHSA-N

> <INCHI>
InChI=1S/C17H14O6/c1-21-13-8-14-17(23-9-22-14)16(20)15(13)12(19)7-4-10-2-5-11(18)6-3-10/h2-8,18,20H,9H2,1H3/b7-4+

> <SMILES>
C12OCOC1=C(O)C(C(=O)/C=C/C1C=CC(O)=CC=1)=C(OC)C=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607630

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$