LMPK12110034
  LIPID_MAPS_STRUCTURE_DATABASE

 29 32  0  0  0  0  0  0  0  0999 V2000
    9.5969    8.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5969    7.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4822    7.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3676    7.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3676    8.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4822    9.1237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2529    7.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1383    7.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1383    8.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2529    9.1237    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2529    6.2822    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0232    9.1236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9254    8.6026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8278    9.1236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8278   10.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9254   10.6864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0232   10.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7119    9.1236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7119    7.0793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8268    7.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9438    7.0804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9438    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6451    8.6517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4623    9.1236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4623   10.0672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6451   10.5391    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2790   10.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4623   11.0105    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
  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  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 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 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  1 18  1  0  0  0  0
  2 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
 14 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 15  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110034

> <COMMON_NAME>
Kanzonol E

> <SYSTEMATIC_NAME>
2-(2,2-Dimethyl-2H-1-benzopyran-6-yl)-7-hydroxy-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one

> <FORMULA>
C25H24O4

> <MASS>
388.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YQCBVKUBTQVHOT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H24O4/c1-15(2)5-6-16-12-19-21(27)14-23(28-24(19)13-20(16)26)17-7-8-22-18(11-17)9-10-25(3,4)29-22/h5,7-14,26H,6H2,1-4H3

> <SMILES>
C1(O)=CC2OC(C3C=CC4OC(C)(C)C=CC=4C=3)=CC(=O)C=2C=C1C/C=C(\C)/C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
168765

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15516846

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 372983

> <CITATION>
-

$$$$