LMPK12140083
  LIPID_MAPS_STRUCTURE_DATABASE

 25 28  0  0  0  0  0  0  0  0999 V2000
    6.4417    6.9531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4417    6.1207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1625    5.7046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8833    6.1207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8833    6.9531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1625    7.3693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6042    5.7046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3250    6.1207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3250    6.9531    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.6042    7.3693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0456    7.3692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7801    6.9449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5148    7.3692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5148    8.2175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7801    8.6416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0456    8.2175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6042    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1625    8.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4567    8.5916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7201    8.1825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7211    7.3692    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3252    8.8663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.9896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7208    5.7045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.1207    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  5  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  6 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
  1 21  1  0  0  0  0
 21 20  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
  2 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140083

> <COMMON_NAME>
Ovalichromene

> <SYSTEMATIC_NAME>


> <FORMULA>
C21H20O4

> <MASS>
336.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NNVQEIPRIPRHHU-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H20O4/c1-21(2)10-9-14-19-15(11-18(23-3)20(14)25-21)16(22)12-17(24-19)13-7-5-4-6-8-13/h4-11,17H,12H2,1-3H3

> <SMILES>
C12OC(C)(C)C=CC=1C1OC(C3C=CC=CC=3)CC(=O)C=1C=C2OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
180254

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607829

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$