LMPK12110346
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
   12.6802    8.8713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6802    7.8916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5287    7.4016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3773    7.8916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3773    8.8713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5287    9.3613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2259    7.4016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0743    7.8916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0743    8.8713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2259    9.3613    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2259    6.3626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9225    9.3610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7875    8.8617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6522    9.3610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6522   10.3597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7875   10.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9225   10.3597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8320    9.3610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5287    6.4223    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.5168   10.8587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4639    7.3566    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5437    6.6732    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9971    7.9932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0957    9.6799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4821    9.4897    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8745    9.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6905    8.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7276    7.6754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9544    8.3354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1385    9.3374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3650    9.9976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4589   11.0114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6011   10.0002    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
 15 20  1  0  0  0  0
 25 31  1  0     0  0
 30 24  1  0     0  0
 24 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  1     0  0
 26 18  1  1     0  0
 27 21  1  6     0  0
 28 22  1  1     0  0
 29 23  1  6     0  0
 31 32  2  0     0  0
 25 33  1  0     0  0
M  END
> <LM_ID>
LMPK12110346

> <COMMON_NAME>
Apigenin 7-(6''-methylglucuronide)

> <SYSTEMATIC_NAME>
4',5-Dihydroxyflavon-7-yl beta-D-glucopyranosiduronic acid methyl ester

> <FORMULA>
C22H20O11

> <MASS>
460.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XXKIWCKZQFBXIR-SXFAUFNYSA-N

> <INCHI>
InChI=1S/C22H20O11/c1-30-21(29)20-18(27)17(26)19(28)22(33-20)31-11-6-12(24)16-13(25)8-14(32-15(16)7-11)9-2-4-10(23)5-3-9/h2-8,17-20,22-24,26-28H,1H3/t17-,18-,19+,20-,22+/m0/s1

> <SMILES>
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(=O)OC)O2)=CC2OC(C3C=CC(O)=CC=3)=CC(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
13844658

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 353917

> <CITATION>
-

$$$$