LMPK12113002
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0  0  0  0  0  0  0  0999 V2000
    5.8709    7.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8709    6.3966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5487    6.0052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2265    6.3966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2265    7.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5487    7.5706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9044    6.0052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5822    6.3966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5822    7.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9044    7.5706    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9044    5.2225    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2600    7.5706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9509    7.1717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6419    7.5707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6417    8.3684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9509    8.7673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2600    8.3684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2600    6.0052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5487    5.2226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3195    8.7598    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9509    9.5500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0061   10.1592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    6.0054    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.5707    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.7892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 25 26  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
  8 18  1  0  0  0  0
  3 19  1  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
  2 23  1  0  0  0  0
  1 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113002

> <COMMON_NAME>
Veronicafolin

> <SYSTEMATIC_NAME>


> <FORMULA>
C18H16O8

> <MASS>
360.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RQJFJWHHIIPKGW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H16O8/c1-23-10-6-8(4-5-9(10)19)17-16(22)14(20)13-11(26-17)7-12(24-2)18(25-3)15(13)21/h4-7,19,21-22H,1-3H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6453535

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$