LMPK12020010
  LIPID_MAPS_STRUCTURE_DATABASE

 31 35  0  0  0  0  0  0  0  0999 V2000
    6.9614   10.1056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2575    9.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2575    8.8865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6652    8.8865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6652    9.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3692    8.4802    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.0731    8.8865    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.0731    9.6993    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.3692   10.1056    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8814   10.3160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6064    9.8975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3315   10.3160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3313   11.1531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6064   11.5716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8814   11.1531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544   10.1051    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9614    8.4802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0558   11.5714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3518    7.7132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6064   12.4080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6397    7.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6397    6.4796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3518    6.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0640    6.4796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0640    7.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9286    7.7124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7883    7.6996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3518    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7760    8.4805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5022    7.2846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9275    6.0684    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
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  8 10  1  6  0  0  0
 10 11  2  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 10  1  0  0  0  0
  2 16  1  0  0  0  0
  3 17  2  0  0  0  0
 17  4  1  0  0  0  0
 13 18  1  0  0  0  0
  6 19  1  1  0  0  0
 14 20  1  0  0  0  0
 19 21  2  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
 24 25  2  0  0  0  0
 25 19  1  0  0  0  0
 21 26  1  0  0  0  0
 25 27  1  0  0  0  0
 23 28  1  0  0  0  0
  7 29  1  1  0  0  0
 27 29  1  0  0  0  0
 27 30  2  0  0  0  0
 22 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020010

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
6-(3,4-Dihydroxyphenyl)-6a,12b-dihydro-3,10,11,12-tetrahydroxy-[2]benzopyrano[3,4-c]benzopyran-8(6H)-one

> <FORMULA>
C22H16O9

> <MASS>
424.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WEZKOSOKVUPYJW-UIFIKXQLSA-N

> <INCHI>
InChI=1S/C22H16O9/c23-9-2-3-10-15(6-9)30-20(8-1-4-12(24)13(25)5-8)21-17(10)16-11(22(29)31-21)7-14(26)18(27)19(16)28/h1-7,17,20-21,23-28H/t17-,20-,21+/m1/s1

> <SMILES>
C1C2O[C@H](C3C=C(O)C(O)=CC=3)[C@H]3OC(=O)C4C(=C(O)C(O)=C(O)C=4)[C@H]3C=2C=CC=1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179156

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14463106

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$