LMPK12113259
  LIPID_MAPS_STRUCTURE_DATABASE

 29 31  0  0  0  0  0  0  0  0999 V2000
    5.8686    7.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8686    6.6043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5442    6.2143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2197    6.6043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2197    7.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5442    7.7745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8953    6.2143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5708    6.6043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5708    7.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8953    7.7745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8953    5.4343    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2464    7.7745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9349    7.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6235    7.7745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6235    8.5695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9349    8.9671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2464    8.5695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5442    5.4343    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2990    8.9596    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5442    8.5546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2197    8.9446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8953    8.5546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2197    9.7246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9349    9.7472    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9866   10.3544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2464    6.2144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2464    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.7745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.9889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 24 25  1  0  0  0  0
 26 27  1  0  0  0  0
 28 29  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
  3 18  1  0  0  0  0
 15 19  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 16 24  1  0  0  0  0
  8 26  1  0  0  0  0
  1 28  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113259

> <COMMON_NAME>
Gossypetin 3,7,3'-trimethyl ether 8-acetate

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H18O9

> <MASS>
402.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OZZUKUSXYKKYEX-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H18O9/c1-9(21)28-18-14(26-3)8-12(23)15-16(24)20(27-4)17(29-19(15)18)10-5-6-11(22)13(7-10)25-2/h5-8,22-23H,1-4H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44260031

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$