LMPK12120116
  LIPID_MAPS_STRUCTURE_DATABASE

 22 23  0  0  0  0  0  0  0  0999 V2000
    6.2484    7.6946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2484    6.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9426    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6368    6.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6368    7.6946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9426    8.0954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3310    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0253    6.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7192    6.4923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4132    6.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1133    6.4887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8134    6.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8134    7.7013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1133    8.1055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4132    7.7013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3310    5.8665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    8.0951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9426    5.6908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5076    6.4921    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5076    5.2441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5076    8.1021    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3992    7.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 19 20  1  0  0  0  0
 21 22  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
  1 17  1  0  0  0  0
  3 18  1  0  0  0  0
 13 21  1  0  0  0  0
 12 19  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120116

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
2',4'-Dihydroxy-3,4-dimethoxychalcone

> <FORMULA>
C17H16O5

> <MASS>
300.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZMMIEHPFMMRMMN-XVNBXDOJSA-N

> <INCHI>
InChI=1S/C17H16O5/c1-21-16-8-4-11(9-17(16)22-2)3-7-14(19)13-6-5-12(18)10-15(13)20/h3-10,18,20H,1-2H3/b7-3+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5953849

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$