LMPK12160003
  LIPID_MAPS_STRUCTURE_DATABASE

 28 31  0     0  0            999 V2000
    7.5595   10.5922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5595    9.6372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3864    9.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2134    9.6372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2134   10.5922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3864   11.0695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0403    9.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8672    9.6372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8672   10.5922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0403   11.0695    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6937    9.1601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6937    8.1391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5779    7.6286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4620    8.1391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4620    9.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5779    9.6705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0403    8.2050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2889    7.6617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   11.0696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5874   10.5922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2889    9.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2889   10.5923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1159   11.0697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9428   10.5923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1159   12.0246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3864    8.2050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5779    6.6738    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6399    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 27 28  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  5  1  0  0  0  0
  8 11  1  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 16  1  0  0  0  0
 16 11  2  0  0  0  0
  7 17  2  0  0  0  0
 14 18  1  0  0  0  0
  1 19  1  0  0  0  0
  9 20  1  0  0  0  0
 20 16  1  0  0  0  0
 15 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
  3 26  1  0  0  0  0
 13 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK12160003

> <COMMON_NAME>
Lisetin

> <SYSTEMATIC_NAME>
1,3,8-Trihydroxy-9-methoxy-7-(3-methyl-2-butenyl)-11H-benzofuro[2,3-b][1]benzopyran-11-one

> <FORMULA>
C21H18O7

> <MASS>
382.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Other Flavonoids [PK1216]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KOHGMAFQELVQRG-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H18O7/c1-9(2)4-5-11-18(24)15(26-3)8-12-16-19(25)17-13(23)6-10(22)7-14(17)27-21(16)28-20(11)12/h4,6-8,22-24H,5H2,1-3H3

> <SMILES>
C1(O)=CC2OC3OC4=C(C=C(OC)C(O)=C4C/C=C(/C)\C)C=3C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44260098

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 62113

> <CITATION>
-

$$$$