LMPK12120048
  LIPID_MAPS_STRUCTURE_DATABASE

 29 30  0  0  0  0  0  0  0  0999 V2000
   14.8826    8.8495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8826    7.8528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7457    7.3546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6088    7.8528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6088    8.8495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7457    9.3479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9322    7.8528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7954    7.3546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0694    7.3547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1991    7.8723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0694    6.3605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1991    8.8624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3416    9.3575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4842    8.8624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4842    7.8723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3416    7.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4720    9.3479    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3416    6.3872    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6270    9.3574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.4717    7.3547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3326    7.8517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1917    7.3558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0509    7.8517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1917    6.3638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6270    7.3774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7714    7.8712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9160    7.3774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.8712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9160    6.3896    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
 17  5  1  0  0  0  0
 18 16  1  0  0  0  0
 14 19  1  0  0  0  0
  4 20  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
 15 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120048

> <COMMON_NAME>
Kanzonol C

> <SYSTEMATIC_NAME>
1-[2,4-Dihydroxy-3-(3-methyl-2-butenyl) phenyl]-3-[3-(3-methyl-2-butenyl)-4-hydroxyphenyl]-2-propene-1-one

> <FORMULA>
C25H28O4

> <MASS>
392.20

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CBGDCCSHOGQUSW-MDWZMJQESA-N

> <INCHI>
InChI=1S/C25H28O4/c1-16(2)5-9-19-15-18(7-12-22(19)26)8-13-23(27)21-11-14-24(28)20(25(21)29)10-6-17(3)4/h5-8,11-15,26,28-29H,9-10H2,1-4H3/b13-8+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5316802

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 372983

> <CITATION>
-

$$$$