LMPK12140072
  LIPID_MAPS_STRUCTURE_DATABASE

 26 30  0  0  0  0  0  0  0  0999 V2000
    6.3228    6.9720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3228    6.1582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0276    5.7512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7324    6.1582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7324    6.9720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0276    7.3790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4371    5.7512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1419    6.1582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1419    6.9720    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.4371    7.3790    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8465    7.3788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5648    6.9640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2831    7.3788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2831    8.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5648    8.6229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8465    8.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4371    5.0624    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0012    8.6228    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6183    7.3788    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5648    9.4521    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0276    8.1924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3230    8.5993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6011    9.6372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6183    8.1924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4088    8.9740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    8.0267    0.0000 C   0  0  0  0  0  0  0  0  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
 14 18  1  0  0  0  0
  1 19  1  0  0  0  0
 15 20  1  0  0  0  0
  6 21  1  0  0  0  0
 21 22  2  0  0  0  0
 20 23  1  0  0  0  0
 23 18  1  0  0  0  0
 22 24  1  0  0  0  0
 24 19  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140072

> <COMMON_NAME>
Ovalichromene B

> <SYSTEMATIC_NAME>
3',4'-Methylenedioxy-6",6"-dimethyl-pyrano [ 2",3":7,8 ] flavanone

> <FORMULA>
C21H18O5

> <MASS>
350.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
JRTNAZKQGYGUQE-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H18O5/c1-21(2)8-7-14-16(26-21)6-4-13-15(22)10-18(25-20(13)14)12-3-5-17-19(9-12)24-11-23-17/h3-9,18H,10-11H2,1-2H3

> <SMILES>
C12OC(C)(C)C=CC=1C1OC(C3C=C4OCOC4=CC=3)CC(=O)C=1C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10981007

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$