LMPK12120583
  LIPID_MAPS_STRUCTURE_DATABASE

 23 25  0  0  0  0  0  0  0  0999 V2000
    6.2497    7.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2497    6.7419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9531    6.3357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6563    6.7419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6563    7.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9531    7.9599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3578    6.3369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0593    6.7419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7608    6.3369    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.4621    6.7419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1456    6.3473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8290    6.7419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8290    7.5311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1456    7.9257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4621    7.5311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3578    5.5270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4773    7.8050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.1478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4773    6.4909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7608    5.5248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6678    5.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9531    5.5237    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8601    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  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
  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 22  1  0  0  0  0
  9 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120583

> <COMMON_NAME>
Ovalitenin B

> <SYSTEMATIC_NAME>


> <FORMULA>
C19H18O4

> <MASS>
310.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AADNEQWIZKTMBL-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H18O4/c1-21-18(13-6-4-3-5-7-13)12-16(20)14-8-9-17-15(10-11-23-17)19(14)22-2/h3-11,18H,12H2,1-2H3

> <SMILES>
C12OC=CC=1C(OC)=C(C(=O)CC(OC)C1C=CC=CC=1)C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
188338

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15160711

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$