LMPK12130060
  LIPID_MAPS_STRUCTURE_DATABASE

 25 29  0     0  0            999 V2000
    8.6957    8.5805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6957    9.6452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7738   10.1775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8517    9.6452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8517    8.5805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7738    8.0481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7083    8.2514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3344    9.1129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7083    9.9743    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1189    9.1129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5526   11.2190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4935   11.3304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   10.3577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5107    9.7916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4319    9.7916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8926   10.5894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4319   11.3871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5107   11.3871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0501   10.5894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5107    8.4339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7935   10.7810    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8898   11.6970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0483   12.0718    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2408    7.3293    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5082    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 24 25  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  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  2  1  0  0  0  0
  8 10  1  0  0  0  0
  3 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13  4  1  0  0  0  0
 10 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 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
 10 20  2  0  0  0  0
 16 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 17  1  0  0  0  0
  7 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12130060

> <COMMON_NAME>
Derriobtusone B

> <SYSTEMATIC_NAME>
2-[(1,3-Benzodioxol-5-yl)oxomethyl]-3-methoxybenzo[1,2-b:3,4-b']difuran

> <FORMULA>
C19H12O6

> <MASS>
336.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Aurone flavonoids [PK1213]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OWIYWIPWFKXOFC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H12O6/c1-21-18-12-3-5-13-11(6-7-22-13)17(12)25-19(18)16(20)10-2-4-14-15(8-10)24-9-23-14/h2-8H,9H2,1H3

> <SMILES>
C12C(OC)=C(C(=O)C3C=CC4OCOC=4C=3)OC=1C1C=COC=1C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607787

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 53864

> <CITATION>
-

$$$$