LMPK12113196
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0     0  0            999 V2000
   11.7125    8.8983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7125    7.8831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5916    7.3754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4709    7.8831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4709    8.8983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5916    9.4059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3502    7.3754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2293    7.8831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2293    8.8983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3502    9.4059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3502    6.5839    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1083    9.4058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0042    8.8885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9005    9.4058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9005   10.4405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0042   10.9578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1083   10.4405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8336    9.4058    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5916    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1083    7.3756    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0042   11.9922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8237   10.9445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5916   10.4207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8194    7.4045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0788    6.4160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3577    7.4288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0999    9.4181    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6044    8.7884    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9659    8.9116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9588    7.9109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0857    7.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2253    7.9231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2324    8.9237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3719    9.4302    0.0000 C   0  0  0  0  0  0  0  0  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
  8 20  1  0  0  0  0
 16 21  1  0  0  0  0
 15 22  1  0  0  0  0
  6 23  1  0  0  0  0
 28 34  1  0     0  0
 33 27  1  0     0  0
 27 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  1     0  0
 29 18  1  1     0  0
 30 24  1  6     0  0
 31 25  1  1     0  0
 32 26  1  6     0  0
M  END
> <LM_ID>
LMPK12113196

> <COMMON_NAME>
Gossypetin 7-glucoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C21H20O13

> <MASS>
480.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ATRBFJXIWFCIMW-ZGNDCXKCSA-N

> <INCHI>
InChI=1S/C21H20O13/c22-5-11-13(26)16(29)18(31)21(33-11)32-10-4-9(25)12-15(28)17(30)19(34-20(12)14(10)27)6-1-2-7(23)8(24)3-6/h1-4,11,13,16,18,21-27,29-31H,5H2/t11-,13-,16+,18-,21-/m1/s1

> <SMILES>
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C(O)C2OC(C3C=C(O)C(O)=CC=3)=C(O)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6452123

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$