LMPK12112994
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    9.5060   -6.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5119   -7.6767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3513   -8.1544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1849   -7.6664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1787   -6.7007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3393   -6.2230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0240   -8.1442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8575   -7.6560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8514   -6.6902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0119   -6.2125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0301   -9.1098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6848   -6.2022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5404   -6.6891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3899   -6.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3837   -5.2075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5283   -4.7205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6788   -5.2178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6969   -8.1337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3574   -9.1202    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5222   -3.7548    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2172   -4.7194    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6368   -6.2167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6306   -5.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6490   -8.1821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7799   -7.6874    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
  8 18  1  0  0  0  0
  3 19  1  0  0  0  0
 16 20  1  0  0  0  0
 15 21  1  0  0  0  0
  1 22  1  0     0  0
 22 23  1  0     0  0
  2 24  1  0     0  0
 24 25  1  0     0  0
M  END
> <LM_ID>
LMPK12112994

> <COMMON_NAME>
Eupatolitin

> <SYSTEMATIC_NAME>
3,3',4',5-tetrahydroxy-6,7-dimethoxyflavone

> <FORMULA>
C17H14O8

> <MASS>
346.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-6,7-dimethoxy-4H-1-benzopyran-4-one

> <INCHI_KEY>
WYKWHSPRHPZRCR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O8/c1-23-11-6-10-12(14(21)17(11)24-2)13(20)15(22)16(25-10)7-3-4-8(18)9(19)5-7/h3-6,18-19,21-22H,1-2H3

> <SMILES>
C1(OC)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O)C(=O)C=2C(O)=C1OC

> <KEGG_ID>
C17788

> <HMDB_ID>
-

> <CHEBI_ID>
81340

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5317291

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1887443

> <CITATION>
-

$$$$