LMPK12112833
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
    7.6233    8.8144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6233    7.8330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4733    7.3421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3235    7.8330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3235    8.8144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4733    9.3052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1736    7.3421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0239    7.8330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0239    8.8144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1736    9.3052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1736    6.3847    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8736    9.3051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7400    8.8050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6066    9.3051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6066   10.3057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7400   10.8058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8736   10.3057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.3287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9892    7.2421    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4726   10.8056    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4733    6.3609    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7795    7.3458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1481    7.7104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9817    7.0535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8147    5.2334    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6557    3.6071    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8259    5.5161    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2357    2.9752    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4060    6.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4022    6.2404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8185    5.3275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2390    4.5145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2428    4.6088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6632    3.7957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6632    3.8007    0.0000 O   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
  2 22  1  0  0  0  0
 22 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  6     0  0
 34 35  2  0     0  0
M  END
> <LM_ID>
LMPK12112833

> <COMMON_NAME>
6-Methoxykaempferol 3-glucuronide

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H20O13

> <MASS>
492.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SADAYGMLZASKCJ-NBHZVLNVSA-N

> <INCHI>
InChI=1S/C22H20O13/c1-32-18-9(24)6-10-11(12(18)25)13(26)19(17(33-10)7-2-4-8(23)5-3-7)34-22-16(29)14(27)15(28)20(35-22)21(30)31/h2-6,14-16,20,22-25,27-29H,1H3,(H,30,31)/t14-,15-,16+,20-,22+/m0/s1

> <SMILES>
C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(=O)O)O3)C(=O)C=2C(O)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101642410

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$