LMPK12112850
  LIPID_MAPS_STRUCTURE_DATABASE

 36 40  0     0  0            999 V2000
   13.0488    8.8485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1502    9.3673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1502   10.4048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0488   10.9237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9476   10.4048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9476    9.3673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2519    8.8485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3533    9.3673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4546    8.8485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4546    7.8108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3533    7.2920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2519    7.8108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5559    9.3673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6574    8.8485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6574    7.8108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5559    7.2920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3533    6.4028    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5559    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6707    9.1690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.3296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6707    7.4901    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7065   10.8430    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0952    7.3238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0004    7.8466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0038   12.3670    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.9726   12.0053    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.6399   10.1232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0267    9.7192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3431    8.5975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6888   10.6639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3374   11.4258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3240   11.2433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6576   10.3022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0090    9.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3426    8.5991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7649    7.7829    0.0000 O   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
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 12  7  2  0  0  0  0
  9 13  1  0  0  0  0
 13 14  2  0  0  0  0
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 16 10  1  0  0  0  0
 11 17  2  0  0  0  0
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 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
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  5 22  1  0  0  0  0
 12 23  1  0  0  0  0
 23 24  1  0  0  0  0
 29 35  1  0     0  0
 34 28  1  0     0  0
 28 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  0     0  0
 34 35  1  1     0  0
 30 22  1  1     0  0
 31 25  1  6     0  0
 32 26  1  1     0  0
 33 27  1  6     0  0
 35 36  2  0     0  0
M  END
> <LM_ID>
LMPK12112850

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,4'-Dihydrox-3-methoxy-6,7-methylenedioxyflavone 4'-glucuronide

> <FORMULA>
C23H20O13

> <MASS>
504.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QZRLCSNTKHSVAP-QJAHINBCSA-N

> <INCHI>
InChI=1S/C23H20O13/c1-31-20-14(25)12-10(6-11-19(13(12)24)33-7-32-11)35-18(20)8-2-4-9(5-3-8)34-23-17(28)15(26)16(27)21(36-23)22(29)30/h2-6,15-17,21,23-24,26-28H,7H2,1H3,(H,29,30)/t15-,16-,17+,21-,23+/m0/s1

> <SMILES>
C1C=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(=O)O)O2)C=CC=1C1=C(OC)C(=O)C2C(O)=C3OCOC3=CC=2O1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
157009796

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$