LMPK12120240
  LIPID_MAPS_STRUCTURE_DATABASE

 29 31  0  0  0  0  0  0  0  0999 V2000
   12.3952    8.9761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3952    8.1724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0914    7.7704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7875    8.1724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7875    8.9761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0914    9.3781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9771    8.1982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6733    7.7962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2812    7.7963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5792    8.2138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2812    6.9946    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5792    9.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8877    9.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1961    9.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1961    8.2138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8877    7.8146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8877    7.0162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0399    7.5307    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.5047    9.4116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2706    9.4116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3598    7.9234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6795    7.5307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6795    6.7452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3598    6.3525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0399    6.7452    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.0000    7.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6735    6.1117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5377    6.3433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4418    5.2475    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
  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
 18 15  1  6  0  0  0
 14 19  1  0  0  0  0
 12 20  1  0  0  0  0
 18 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 18  1  0  0  0  0
 22 26  1  0  0  0  0
 25 27  1  1  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120240

> <COMMON_NAME>
Linderachalcone

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H28O4

> <MASS>
392.20

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AFJBDWHCOLAFQN-LZNDSBFYSA-N

> <INCHI>
InChI=1S/C25H28O4/c1-15(2)18-11-9-16(3)13-19(18)23-21(27)14-22(28)24(25(23)29)20(26)12-10-17-7-5-4-6-8-17/h4-8,10,12-15,18-19,27-29H,9,11H2,1-3H3/b12-10+/t18-,19+/m1/s1

> <SMILES>
C1=CC=CC=C1/C=C/C(=O)C1C(O)=C([C@@H]2[C@@H](C(C)C)CCC(C)=C2)C(O)=CC=1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
197229

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607599

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$