LMPK12120246
  LIPID_MAPS_STRUCTURE_DATABASE

 21 22  0  0  0  0  0  0  0  0999 V2000
    5.8865    7.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8865    6.2006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5797    5.8003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2731    6.2006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2731    7.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5797    7.4013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9664    5.8003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6598    6.2006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3528    5.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0458    6.2006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7451    5.7969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4441    6.2006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4441    7.0080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7451    7.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0458    7.0080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9664    5.1755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5797    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9664    7.4015    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8570    6.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.4015    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.6478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  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
  3 17  1  0  0  0  0
  5 18  1  0  0  0  0
  1 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120246

> <COMMON_NAME>
Flavokawin B

> <SYSTEMATIC_NAME>


> <FORMULA>
C17H16O4

> <MASS>
284.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QKQLSQLKXBHUSO-CMDGGOBGSA-N

> <INCHI>
InChI=1S/C17H16O4/c1-20-13-10-15(19)17(16(11-13)21-2)14(18)9-8-12-6-4-3-5-7-12/h3-11,19H,1-2H3/b9-8+

> <SMILES>
C1(OC)=CC(OC)=C(C(=O)/C=C/C2C=CC=CC=2)C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0033691

> <CHEBI_ID>
65899

> <ABBREVIATION>
-

> <CAYMAN_ID>
19652

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5356121

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$