LMPK12113174
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0     0  0            999 V2000
    7.5637    9.4141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5637    8.4543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3950    7.9742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2264    8.4543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2264    9.4141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3950    9.8941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0577    7.9742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8891    8.4543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8891    9.4141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0577    9.8941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0577    7.2257    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7201    9.8940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5675    9.4049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4149    9.8940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4149   10.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5675   11.3616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7201   10.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.8940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8576    7.6319    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2620   11.3614    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3950    7.0147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5675   12.3395    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3950   10.8537    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7429    8.3031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2673    7.0055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9042    5.0418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4391    5.9985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8844    3.8690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6187    6.9856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5615    7.3213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3246    6.6698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1431    5.6881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2003    5.3524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0188    4.3706    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
 19  8  1  0  0  0  0
 15 20  1  0  0  0  0
  3 21  1  0  0  0  0
 16 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 19  1  1     0  0
 30 24  1  6     0  0
 31 25  1  1     0  0
 32 26  1  1     0  0
M  END
> <LM_ID>
LMPK12113174

> <COMMON_NAME>
Gossypetin 3-galactoside

> <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>
TYEYAUURGXCDJR-MBRPKMFXSA-N

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

> <SMILES>
C1(O)=C(O)C2OC(C3C=C(O)C(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44259973

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$