LMPK12120584
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0  0  0  0  0  0  0  0999 V2000
    8.5967    6.0726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4418    6.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4418    7.5362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5967    8.0241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7517    7.5362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7517    6.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9071    6.0709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.5362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5967    8.8652    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8005    9.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2696    8.0142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0808    7.5458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2696    8.7480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9048    8.0216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9048    8.9024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4951    9.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7663    7.5242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7663    6.5485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6113    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6113    8.0121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4562    6.5485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4562    7.5242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3009    8.0138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1475    7.5242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1475    6.5485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  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  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  5  9  1  0  0  0  0
  4 10  1  0  0  0  0
 10 11  1  0  0  0  0
  3 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 22  2  0  0  0  0
 23 21  2  0  0  0  0
 21 18  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 22 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120584

> <COMMON_NAME>
Ponganone IX

> <SYSTEMATIC_NAME>
3-(1,3-Benzodioxol-5-yl)-3-methoxy-1-(4-methoxy-5-benzofuranyl)-1-propanone

> <FORMULA>
C20H18O6

> <MASS>
354.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RANWLOKZQCJYQF-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H18O6/c1-22-18(12-3-5-17-19(9-12)26-11-25-17)10-15(21)13-4-6-16-14(7-8-24-16)20(13)23-2/h3-9,18H,10-11H2,1-2H3

> <SMILES>
C1=CC(C(=O)CC(C2C=C3OCOC3=CC=2)OC)=C(OC)C2C=COC1=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15160710

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 56065

> <CITATION>
-

$$$$