LMPK12113239
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    6.2444    7.2395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2444    6.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9345    6.0443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6245    6.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6245    7.2395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9345    7.6379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3145    6.0443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0046    6.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0046    7.2395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3145    7.6379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3145    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6946    7.6379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3979    7.2319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1011    7.6379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1011    8.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3979    8.8559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6946    8.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.6379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9345    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9345    8.4347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3979    9.6526    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7911    8.8484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6774    8.3366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6946    6.0443    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7689    6.6645    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
 16 21  1  0  0  0  0
 15 22  1  0  0  0  0
  8 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113239

> <COMMON_NAME>
Gossypetin 3,4'-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>
PBBXHFKIHMKJCA-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O8/c1-23-11-4-3-7(5-8(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(O)C(OC)=CC=3)=C(OC)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0129289

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5321861

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$