LMPK12120467
  LIPID_MAPS_STRUCTURE_DATABASE

 28 30  0  0  0  0  0  0  0  0999 V2000
    7.8699    7.2856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5777    7.6941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5779    8.5114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8700    8.9201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1624    8.5115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1624    7.6941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8700    9.7371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1624   10.1456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1624   10.9628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4549   11.3712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4549   12.2113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7275   12.6312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000   12.2112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000   11.3712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7275   10.9513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2854    8.9198    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5776   10.1456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4549    7.2855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4549    6.4685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8190    6.1012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8192    5.3670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4552    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0909    5.3673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0906    6.1013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1114    6.5097    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8699    6.4686    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4549    8.9200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2300    8.2128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 27 28  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  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
  3 16  1  0  0  0  0
  7 17  2  0  0  0  0
  6 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  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
 23 24  2  0  0  0  0
 24 19  1  0  0  0  0
 20 25  1  0  0  0  0
  1 26  1  0  0  0  0
  5 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120467

> <COMMON_NAME>
Isouvaretin

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H22O5

> <MASS>
378.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WKYGVDYQMIWYES-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C23H22O5/c1-28-23-17(13-16-9-5-6-10-18(16)24)20(26)14-21(27)22(23)19(25)12-11-15-7-3-2-4-8-15/h2-10,14,24,26-27H,11-13H2,1H3

> <SMILES>
C1(O)C(CC2C=CC=CC=2O)=C(OC)C(C(=O)CCC2C=CC=CC=2)=C(O)C=1

> <KEGG_ID>
C09759

> <HMDB_ID>
-

> <CHEBI_ID>
6068

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
151670

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$