LMPK12020156
  LIPID_MAPS_STRUCTURE_DATABASE

 21 24  0  0  0  0  0  0  0  0999 V2000
    5.5556    6.9672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5556    6.2195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2032    5.8456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8507    6.2195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8507    6.9672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2032    7.3410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4983    5.8456    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.1458    6.2195    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.1458    6.9672    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.4983    7.3410    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.4675    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5849    6.1363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8473    5.0667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5849    5.3788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2410    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8970    5.3788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8970    6.1363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2410    6.5151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5526    6.5149    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5526    5.0002    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7931    5.8457    0.0000 O   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  1  0  0  0
  9  8  1  1  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
 11  1  1  0  0  0  0
  9 12  1  0  0  0  0
  7 13  1  0  0  0  0
 12 14  2  0  0  0  0
 14 13  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 12  1  0  0  0  0
 17 19  1  0  0  0  0
 16 20  1  0  0  0  0
  8 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020156

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
6,12-Methano-6H,12H-dibenzo[b,f][1,5]dioxocin-2,3,9,13-tetrol

> <FORMULA>
C15H12O6

> <MASS>
288.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavans, Flavanols and Leucoanthocyanidins [PK1202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NREPOMIEDIKIAZ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H12O6/c16-6-1-2-7-11(3-6)20-15-8-4-9(17)10(18)5-12(8)21-14(7)13(15)19/h1-5,13-19H

> <SMILES>
C1(O)=CC2O[C@H]3C4C=C(O)C(O)=CC=4O[C@H](C3O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257131

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$