LMPK12120003
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0  0  0  0  0  0  0  0999 V2000
    7.5917    9.2844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5917    8.2895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4534    7.7919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3153    8.2895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3153    9.2844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4534    9.7820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1770    7.7919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0388    8.2895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9001    7.7922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7616    8.2895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6305    7.7878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4996    8.2895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4996    9.2929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6305    9.7946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7616    9.2929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1770    7.0154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6453    9.5919    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    8.7868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6453    7.9820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4534    6.7969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5603    6.1579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  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
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19  2  1  0  0  0  0
  3 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120003

> <COMMON_NAME>
Ovalitenin A

> <SYSTEMATIC_NAME>
1-(4-Methoxybenzofuran-5-yl)-3-phenyl-2-propen-1-one

> <FORMULA>
C18H14O3

> <MASS>
278.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KEJNXXMRDHDOCO-VQHVLOKHSA-N

> <INCHI>
InChI=1S/C18H14O3/c1-20-18-14(8-10-17-15(18)11-12-21-17)16(19)9-7-13-5-3-2-4-6-13/h2-12H,1H3/b9-7+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186152

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10923878

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 53625

> <CITATION>
-

$$$$