LMPK12120372
  LIPID_MAPS_STRUCTURE_DATABASE

 25 28  0  0  0  0  0  0  0  0999 V2000
    7.5795    9.1619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5795    8.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4342    7.6815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2890    8.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2890    9.1619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4342    9.6554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1438    7.6815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9985    8.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8533    7.6815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7080    8.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5701    7.6773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4320    8.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4320    9.1704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5701    9.6679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7080    9.1704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1438    6.6944    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8533    6.6944    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3787    7.8674    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9638    8.6727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3787    9.4778    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6409    9.4669    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6409    7.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4342    6.6944    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5321    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 24 25  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  1  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  2  0  0  0  0
 12 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 13  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23  2  1  0  0  0  0
  3 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120372

> <COMMON_NAME>
Ovalitenone

> <SYSTEMATIC_NAME>
1-(1,3-Benzodioxol-5-yl)-3-(4-methoxybenzofuran-5-yl)-1,3-propanedione

> <FORMULA>
C19H14O6

> <MASS>
338.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SDJBCBKWKASUCJ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H14O6/c1-22-19-12(3-5-16-13(19)6-7-23-16)15(21)9-14(20)11-2-4-17-18(8-11)25-10-24-17/h2-8H,9-10H2,1H3

> <SMILES>
C12OC=CC1=C(OC)C(C(=O)CC(=O)C1C=CC3OCOC=3C=1)=CC=2

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0030619

> <CHEBI_ID>
175301

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
627910

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 53625

> <CITATION>
-

$$$$