LMPK12113306
  LIPID_MAPS_STRUCTURE_DATABASE

 32 34  0  0  0  0  0  0  0  0999 V2000
    6.4760    7.4493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4750    6.6665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1524    6.2745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8307    6.6649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8317    7.4477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1542    7.8398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5084    6.2736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1863    6.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1873    7.4462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5099    7.8382    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5084    5.4909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8651    7.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5557    7.4387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2467    7.8358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2476    8.6335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5572    9.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8660    8.6351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1524    5.4919    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7982    7.8407    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1542    8.6226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4764    9.0138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4764    9.7965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7987    8.6226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7987   10.1878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7987   10.9705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1542   10.1878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6081    7.4342    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5864    7.2036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9264    5.9250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7196    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9962    7.2856    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.1504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 27 28  1  0  0  0  0
 29 30  1  0  0  0  0
 31 32  1  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
  1 19  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
 24 25  1  0  0  0  0
 22 26  1  0  0  0  0
 15 27  1  0  0  0  0
  8 29  1  0  0  0  0
  2 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113306

> <COMMON_NAME>
Pratensin A

> <SYSTEMATIC_NAME>
5,7,8-Trihydroxy-3,6,4'-trimethoxyflavone 8-tiglate

> <FORMULA>
C23H22O9

> <MASS>
442.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MJKSKSYTKXRLCZ-IZZDOVSWSA-N

> <INCHI>
InChI=1S/C23H22O9/c1-6-11(2)23(27)32-22-17(26)20(29-4)15(24)14-16(25)21(30-5)18(31-19(14)22)12-7-9-13(28-3)10-8-12/h6-10,24,26H,1-5H3/b11-6+

> <SMILES>
C1(O)=C(OC(=O)/C(/C)=C/C)C2OC(C3C=CC(OC)=CC=3)=C(OC)C(=O)C=2C(O)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
166636

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15736235

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$