LMPK12050309
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0     0  0            999 V2000
    7.5651   11.3492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5651   10.3879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3976    9.9073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2300   10.3879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2300   11.3492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3976   11.8299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0625    9.9073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8950   10.3879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8950   11.3492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0625   11.8299    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7273    9.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7273    8.8797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6173    8.3659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5074    8.8797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5074    9.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6173   10.4214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0625    8.9463    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3976    8.9463    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3966    8.3663    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   11.8299    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6173    7.3380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5074    6.8242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3966    7.3380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4803    7.6284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9608    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8380    8.3663    0.0000 O   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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 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
  3 18  1  0  0  0  0
 14 19  1  0  0  0  0
  1 20  1  0  0  0  0
 13 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 19  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 12 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050309

> <COMMON_NAME>
Licoisoflavone B

> <SYSTEMATIC_NAME>
5,7-Dihydroxy-3-(5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-4H-1-benzopyran-4-one

> <FORMULA>
C20H16O6

> <MASS>
352.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KIZPADOTOCPASX-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H16O6/c1-20(2)6-5-12-15(26-20)4-3-11(18(12)23)13-9-25-16-8-10(21)7-14(22)17(16)19(13)24/h3-9,21-23H,1-2H3

> <SMILES>
C1(O)=CC2OC=C(C3C=CC4OC(C)(C)C=CC=4C=3O)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5481234

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 46347

> <CITATION>
-

$$$$