LMPK12110704
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0     0  0            999 V2000
    7.6490    9.0267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6490    7.9103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5449    7.3929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4407    7.9103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4407    8.9448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5449    9.4619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3368    7.3929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2328    7.9103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2328    8.9448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3368    9.4619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3368    6.3975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1284    9.4617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0415    8.9346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9545    9.4617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9545   10.5163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0415   11.0435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1284   10.5163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5449    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.5557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8676   11.0435    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8752    8.9444    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.6155    9.9328    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3419    8.9196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3253    6.9227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7314    7.4369    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.5245    5.5906    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7371    8.4401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6072    8.9343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4719    8.4253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4634    7.4270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5933    6.9328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5850    5.9343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7629    5.3648    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1942    7.4177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0573    6.9127    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.2000    8.4177    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
  3 18  1  0  0  0  0
 19  1  1  0  0  0  0
 15 20  1  0  0  0  0
 14 21  1  0  0  0  0
 26 32  1  0     0  0
 31 25  1  0     0  0
 25 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  0     0  0
 31 32  1  1     0  0
 27 21  1  1     0  0
 28 22  1  6     0  0
 29 23  1  1     0  0
 30 24  1  6     0  0
 32 33  2  0     0  0
 24 34  1  0     0  0
 34 35  2  0     0  0
 34 36  1  0     0  0
M  END
> <LM_ID>
LMPK12110704

> <COMMON_NAME>
Luteolin 3'-(4''-acetylglucuronide)

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H20O13

> <MASS>
504.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YXAMANJJQIUXMQ-UNRHHUQTSA-N

> <INCHI>
InChI=1S/C23H20O13/c1-8(24)33-20-18(29)19(30)23(36-21(20)22(31)32)35-15-4-9(2-3-11(15)26)14-7-13(28)17-12(27)5-10(25)6-16(17)34-14/h2-7,18-21,23,25-27,29-30H,1H3,(H,31,32)/t18-,19-,20+,21+,23-/m1/s1

> <SMILES>
C1(O)=CC2OC(C3C=CC(O)=C(O[C@H]4[C@H](O)[C@@H](O)[C@H](OC(C)=O)[C@@H](C(=O)O)O4)C=3)=CC(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10097618

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$