LMPK12120371
  LIPID_MAPS_STRUCTURE_DATABASE

 31 33  0  0  0  0  0  0  0  0999 V2000
    7.9429   10.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9429    9.2271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8320    8.7138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7212    9.2271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7212   10.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8320   10.7674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6103    8.7138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4995    9.2271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3882    8.7142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2770    9.2271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1738    8.7094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0704    9.2271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0704   10.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1738   10.7803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2770   10.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6103    7.9126    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3882    7.6899    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9669   10.7801    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9669    8.7097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9669    7.6497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8842    7.1200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8016    7.6497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8842    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6186   11.7716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5974   11.8787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1800   10.9409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1576   12.6407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6003   13.4075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   13.0657    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2995   12.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8320    7.6875    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 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
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
  6 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26  1  1  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 30  1  0  0  0  0
  3 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120371

> <COMMON_NAME>
Glyinflanin F

> <SYSTEMATIC_NAME>
1-[[2-(1-Methyl-1-hydroxyethyl)-6-Hydroxy-2,3-dihydrobenzofuran]-5-yl]-3-[3-(3-methyl-2-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>
UMJBXAGJIISZLL-NDENLUEZSA-N

> <INCHI>
InChI=1S/C25H28O6/c1-14(2)5-6-15-9-16(7-8-19(15)26)20(27)12-21(28)18-10-17-11-24(25(3,4)30)31-23(17)13-22(18)29/h5,7-10,12-13,24,26-27,29-30H,6,11H2,1-4H3/b20-12-

> <SMILES>
C12OC(C(C)(O)C)CC=1C=C(C(=O)/C=C(\O)/C1C=CC(O)=C(C/C=C(/C)\C)C=1)C(O)=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607640

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 74614

> <CITATION>
-

$$$$