LMPK12120379
  LIPID_MAPS_STRUCTURE_DATABASE

 31 32  0  0  0  0  0  0  0  0999 V2000
    8.6563   10.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6563    9.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5224    8.9450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3885    9.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3885   10.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5224   10.9451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2546    8.9450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1207    9.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9864    8.9451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8522    9.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7257    8.9408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5991    9.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5991   10.4535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7257   10.9577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8522   10.4535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2546    8.1643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9864    7.9474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4722   10.9577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4722    8.9408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7902    8.9450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7902    7.9451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9244    7.4454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    7.9442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9244    6.4477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7906   10.9450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2543   10.9450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4722    7.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3658    7.3923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5786    7.3923    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2593    7.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3658    6.3605    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  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
  9 17  1  0  0  0  0
 13 18  1  0  0  0  0
 12 19  1  0  0  0  0
 20  2  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
  1 25  1  0  0  0  0
  5 26  1  0  0  0  0
 19 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 28 30  2  0  0  0  0
 28 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120379

> <COMMON_NAME>
Glyinflanin E

> <SYSTEMATIC_NAME>
1-[2,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-3-[3-(2-hydroxy-3-methyl-3-butenyl)-4-hydroxyphenyl]propane-1,3-dione

> <FORMULA>
C25H28O6

> <MASS>
424.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
VYEJOOFTJRPOCV-UUYOSTAYSA-N

> <INCHI>
InChI=1S/C25H28O6/c1-14(2)5-6-17-10-19(25(31)13-23(17)29)24(30)12-22(28)16-7-8-20(26)18(9-16)11-21(27)15(3)4/h5,7-10,12-13,21,26-29,31H,3,6,11H2,1-2,4H3/b22-12-

> <SMILES>
C1(O)=CC(O)=C(C(=O)/C=C(\O)/C2C=CC(O)=C(CC(O)C(C)=C)C=2)C=C1C/C=C(/C)\C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
168190

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607643

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 74614

> <CITATION>
-

$$$$