LMPK12111164
  LIPID_MAPS_STRUCTURE_DATABASE

 23 25  0  0  0  0  0  0  0  0999 V2000
    6.4064    7.2698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4064    6.4577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1096    6.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8129    6.4577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8129    7.2698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1096    7.6758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5161    6.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2193    6.4577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2193    7.2698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5161    7.6758    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5161    5.2397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9225    7.6758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6391    7.2621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3559    7.6758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3559    8.5034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6391    8.9173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9225    8.5034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7032    7.6758    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1096    5.2397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7032    6.0517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0592    8.9095    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9624    8.3879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  1  0  0  0  0
 22 23  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
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 15 22  1  0  0  0  0
  2 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111164

> <COMMON_NAME>
Pectolinarigenin

> <SYSTEMATIC_NAME>


> <FORMULA>
C17H14O6

> <MASS>
314.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GPQLHGCIAUEJQK-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O6/c1-21-10-5-3-9(4-6-10)13-7-11(18)15-14(23-13)8-12(19)17(22-2)16(15)20/h3-8,19-20H,1-2H3

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

> <KEGG_ID>
C17784

> <HMDB_ID>
HMDB0128589

> <CHEBI_ID>
81336

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5320438

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$