LMPK12113238
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    6.2378    6.9727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2378    6.1837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9211    5.7891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6045    6.1837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6045    6.9727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9211    7.3673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2879    5.7891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9713    6.1837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9713    6.9727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2879    7.3673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2879    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6546    7.3673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3511    6.9651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0477    7.3673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0477    8.1715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3511    8.5736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6546    8.1715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.3673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9211    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9211    8.1564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7310    8.5661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6546    5.7891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7184    6.4033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3511    9.3626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4149    9.9768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 22 23  1  0  0  0  0
 24 25  1  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  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 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 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
  6 20  1  0  0  0  0
 15 21  1  0  0  0  0
  8 22  1  0  0  0  0
 16 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113238

> <COMMON_NAME>
Gossypetin 3,3'-dimethyl ether

> <SYSTEMATIC_NAME>


> <FORMULA>
C17H14O8

> <MASS>
346.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PWJLQVDWQPUCIF-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O8/c1-23-11-5-7(3-4-8(11)18)15-17(24-2)14(22)12-9(19)6-10(20)13(21)16(12)25-15/h3-6,18-21H,1-2H3

> <SMILES>
C1(O)=C(O)C2OC(C3C=C(OC)C(O)=CC=3)=C(OC)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0129281

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21676153

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$