LMPK12110427
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0  0  0  0  0  0  0  0999 V2000
    9.1258    6.4851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1258    7.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4113    7.7226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6967    7.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6967    6.4851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4113    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8402    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5548    6.4851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5548    7.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8402    7.7226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2693    7.7227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9837    7.3102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6983    7.7227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6983    8.5478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9837    8.9603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2693    8.5478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8402    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4113    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4128    8.9603    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9822    7.7226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2677    7.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2677    6.4851    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.9822    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4552    7.1669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9855    8.0855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    6.0732    0.0000 O   0  0  0  0  0  0  0  0  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
  1  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  2  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
  6 18  1  0  0  0  0
 19 14  1  0  0  0  0
  4 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23  5  1  0  0  0  0
 21 24  1  0  0  0  0
 21 25  1  0  0  0  0
 22 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110427

> <COMMON_NAME>
Dinklagin B

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H18O6

> <MASS>
354.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FJVQQAWOOLFVQM-UHFFFAOYSA-N

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

> <SMILES>
C12C(=O)C=C(C3C=CC(O)=CC=3)OC=1C=C1OC(C)(C)C(O)CC1=C2O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
193280

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257869

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$