LMPK12120375
  LIPID_MAPS_STRUCTURE_DATABASE

 26 27  0  0  0  0  0  0  0  0999 V2000
    7.0749    8.1945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0749    7.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7665    6.9965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4581    7.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4581    8.1945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7665    8.5937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1497    6.9965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8414    7.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5330    6.9965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2246    7.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9221    6.9932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6195    7.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6195    8.2013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9221    8.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2246    8.2013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1497    6.1979    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5330    6.1979    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3832    6.9965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3832    6.1979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6916    5.7985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.1979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6916    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3832    8.5939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3832    9.8371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1497    8.5939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0379    8.0810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 23 24  1  0  0  0  0
 25 26  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
  9 17  1  0  0  0  0
 18  2  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
  1 23  1  0  0  0  0
  5 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120375

> <COMMON_NAME>
Pongagallone A

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H24O4

> <MASS>
352.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HYEHSSXMOHMVLQ-UYRXBGFRSA-N

> <INCHI>
InChI=1S/C22H24O4/c1-15(2)10-11-17-12-18(22(26-4)14-21(17)25-3)20(24)13-19(23)16-8-6-5-7-9-16/h5-10,12-14,23H,11H2,1-4H3/b19-13-

> <SMILES>
C1(OC)=CC(OC)=C(C(=O)/C=C(\O)/C2C=CC=CC=2)C=C1C/C=C(/C)\C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186989

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14483495

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$