LMPK12111388
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
    8.8732    8.8856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8732    7.7907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7518    7.2834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6306    7.7907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6306    8.8054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7518    9.3126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5090    7.2834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3878    7.7907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3878    8.8054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5090    9.3126    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5090    6.3638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2661    9.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1616    8.7954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0571    9.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0571   10.3466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1616   10.8634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2661   10.3466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9748    9.4044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8616   10.8111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7879   10.3243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7518    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1616   11.7674    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9904   12.2460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5123   11.8665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2103   13.7426    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1798   14.0730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1239   11.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6308   13.5157    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1349   11.2606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4971   12.0317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8482   12.9716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8329   13.1367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4706   12.3656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4554   12.5307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1590   11.8201    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
 18  1  1  0  0  0  0
 15 19  1  0  0  0  0
  6 20  1  0  0  0  0
  3 21  1  0  0  0  0
 16 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 20  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>
LMPK12111388

> <COMMON_NAME>
8-Hydroxyluteolin 3'-methyl ether 8-glucuronide

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H20O13

> <MASS>
492.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
8-Hydroxychrysoeriol 8-glucuronide

> <INCHI_KEY>
XMUSFCCVYDPKCR-NTKSAMNMSA-N

> <INCHI>
InChI=1S/C22H20O13/c1-32-13-4-7(2-3-8(13)23)12-6-10(25)14-9(24)5-11(26)18(19(14)33-12)34-22-17(29)15(27)16(28)20(35-22)21(30)31/h2-6,15-17,20,22-24,26-29H,1H3,(H,30,31)/t15-,16-,17+,20-,22+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258606

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$