LMPK12111621
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0     0  0            999 V2000
   13.0060   10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1099   11.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1099   12.1033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0060   12.6208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9022   12.1033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9022   11.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2136   10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3174   11.0684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4212   10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4212    9.5162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3174    8.9987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2136    9.5162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5250   11.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6288   10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6288    9.5162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5250    8.9987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3174    8.1120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   11.0684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5250    8.0699    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0272    9.0464    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2936   12.5745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0060    9.7053    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8138    8.8466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9741    6.8513    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3288    5.7196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2622    8.1392    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7782    5.6115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0873    8.7101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9911    8.2808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0702    7.2805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2475    6.7148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3436    7.1441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5209    6.5782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
  9 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 10  1  0  0  0  0
 14 18  1  0  0  0  0
 11 17  2  0  0  0  0
 16 19  1  0  0  0  0
 12 20  1  0  0  0  0
  3 21  1  0  0  0  0
  1 22  1  0  0  0  0
 27 33  1  0     0  0
 32 26  1  0     0  0
 26 28  1  0     0  0
 28 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  1     0  0
 28 22  1  1     0  0
 29 23  1  6     0  0
 30 24  1  1     0  0
 31 25  1  6     0  0
M  END
> <LM_ID>
LMPK12111621

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3,5,7,2',6'-Pentahydroxyflavone 2'-glucoside

> <FORMULA>
C21H20O12

> <MASS>
464.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WLCYEFFWFTVKQR-GFOOFYSOSA-N

> <INCHI>
InChI=1S/C21H20O12/c22-6-12-15(26)17(28)19(30)21(33-12)32-10-3-1-2-8(24)14(10)20-18(29)16(27)13-9(25)4-7(23)5-11(13)31-20/h1-5,12,15,17,19,21-26,28-30H,6H2/t12-,15-,17+,19-,21-/m1/s1

> <SMILES>
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=CC=C(O)C=1C1=C(O)C(=O)C2C(O)=CC(O)=CC=2O1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
51136588

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$