LMPK12113244
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0  0  0  0  0  0  0  0999 V2000
    7.1087    8.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1087    7.4706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9227    7.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7369    7.4706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7369    8.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9227    8.8807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5510    7.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3652    7.4706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3652    8.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5510    8.8807    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5510    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1792    8.8807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0090    8.4015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8387    8.8807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8387    9.8387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0090   10.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1792    9.8387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9227    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9227    9.8208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6528   10.3088    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0090   11.2579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2764   11.9896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1792    7.0006    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4466    7.7324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945    8.8807    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945   10.3441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 25 26  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
  6 19  1  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
  8 23  1  0  0  0  0
  1 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113244

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

> <SYSTEMATIC_NAME>
5,8,4'-Trihydroxy-3,7,3'-trimethoxyflavone

> <FORMULA>
C18H16O8

> <MASS>
360.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MNPHMLPMBGJDJI-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H16O8/c1-23-11-6-8(4-5-9(11)19)16-18(25-3)15(22)13-10(20)7-12(24-2)14(21)17(13)26-16/h4-7,19-21H,1-3H3

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0129270

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
13983747

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 66636

> <CITATION>
-

$$$$