LMPK12120076
  LIPID_MAPS_STRUCTURE_DATABASE

 24 26  0  0  0  0  0  0  0  0999 V2000
   10.6552    7.0294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6552    6.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3589    5.8104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0627    6.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0627    7.0294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3589    7.4356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0650    6.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7687    5.8104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3615    5.8105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6519    6.2326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3615    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6519    7.0399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9527    7.4435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2536    7.0399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2536    6.2326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9527    5.8290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.4435    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7664    5.8104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4702    6.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4702    7.0294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7664    7.4356    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1521    7.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2935    6.8088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9527    5.0219    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
 14 17  1  0  0  0  0
  4 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21  5  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 16 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120076

> <COMMON_NAME>
Kanzonol B

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H18O4

> <MASS>
322.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
TUHJQMZJOMZXJO-XVNBXDOJSA-N

> <INCHI>
InChI=1S/C20H18O4/c1-20(2)10-9-14-11-13(4-8-19(14)24-20)3-7-17(22)16-6-5-15(21)12-18(16)23/h3-12,21,23H,1-2H3/b7-3+

> <SMILES>
C1=CC2OC(C)(C)C=CC=2C=C1/C=C/C(=O)C1C(O)=CC(O)=CC=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
184832

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10881804

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$