LMPK12120003
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0  0  0  0  0  0  0  0999 V2000
    6.2632    7.6597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2632    6.8389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9741    6.4284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6852    6.8389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6852    7.6597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9741    8.0702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3961    6.4284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1071    6.8389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8177    6.4286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5284    6.8389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2453    6.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9623    6.8389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9623    7.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2453    8.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5284    7.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3961    5.7878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4824    7.9134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.2492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4824    6.5852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9741    5.6075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8873    5.0803    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>


> <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

> <CITATION>
-

$$$$