LMPK12120138
  LIPID_MAPS_STRUCTURE_DATABASE

 31 33  0  0  0  0  0  0  0  0999 V2000
   15.0674    7.2098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0674    6.4138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7567    6.0158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4460    6.4138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4460    7.2098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7567    7.6077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6632    6.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3525    6.0414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9741    6.0415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2791    6.4549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9741    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2791    7.2456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5942    7.6410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9094    7.2456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9094    6.4549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5942    6.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5942    5.2689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2248    6.0596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5942    8.4316    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5401    6.4549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2248    7.6409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5401    7.2455    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.7545    6.7918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9695    7.2451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1845    6.7918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3995    7.2451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6145    6.7918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3995    8.1515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0604    8.0763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1351    7.6076    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.7330    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
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
  2  8  1  0  0  0  0
 10 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 10  1  0  0  0  0
 16 17  1  0  0  0  0
 15 18  1  0  0  0  0
 13 19  1  0  0  0  0
 18 20  2  0  0  0  0
 14 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 20  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 22 29  1  0  0  0  0
  5 30  1  0  0  0  0
 26 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120138

> <COMMON_NAME>
Flemingin E

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H26O6

> <MASS>
422.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SGHBNSQYQUYLSA-FFKWBEBTSA-N

> <INCHI>
InChI=1S/C25H26O6/c1-24(2,30)12-4-13-25(3)14-11-18-22(29)19(15-21(28)23(18)31-25)20(27)10-7-16-5-8-17(26)9-6-16/h4-12,14-15,26,28-30H,13H2,1-3H3/b10-7+,12-4+

> <SMILES>
C1=CC(O)=CC=C1/C=C/C(=O)C1C(O)=C2C=CC(C)(C/C=C/C(O)(C)C)OC2=C(O)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607550

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$