LMPK12140462
  LIPID_MAPS_STRUCTURE_DATABASE

 31 33  0     0  0            999 V2000
    7.5948    8.8501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5948    7.8541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4574    7.3560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3199    7.8541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3199    8.8501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4574    9.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1825    7.3560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0449    7.8541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0449    8.8501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1825    9.3480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9072    9.3478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7862    8.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6652    9.3478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6652   10.3628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7862   10.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9072   10.3628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1825    6.5130    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4574    6.3605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.3478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5440   10.8703    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0284   10.8703    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5440    8.8404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4211    9.3468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2981    8.8404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1731    9.3457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2981    7.8298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0466    8.8415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9179    9.3446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7894    8.8415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6608    9.3446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7894    7.8353    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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  0  0  0
 11 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 11  1  0  0  0  0
  7 17  2  0  0  0  0
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 14 20  1  0  0  0  0
 16 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140462

> <COMMON_NAME>
Kuwanon E

> <SYSTEMATIC_NAME>
2-[5-[(E)-3,7-Dimethyl-2,6-octadienyl]-2,4-dihydroxyphenyl]-2,3-dihydro-5,7-dihydroxy-4H-1-benzopyran-4-one

> <FORMULA>
C25H28O6

> <MASS>
424.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GJFHZVPRFLHEBR-VIZOYTHASA-N

> <INCHI>
InChI=1S/C25H28O6/c1-14(2)5-4-6-15(3)7-8-16-9-18(20(28)12-19(16)27)23-13-22(30)25-21(29)10-17(26)11-24(25)31-23/h5,7,9-12,23,26-29H,4,6,8,13H2,1-3H3/b15-7+

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0030862

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10342292

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3498

> <CITATION>
-

$$$$