LMPK12113415
  LIPID_MAPS_STRUCTURE_DATABASE

 19 21  0     0  0            999 V2000
    9.3429   -4.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2089   -5.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2089   -6.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3429   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4769   -6.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4769   -5.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0750   -4.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9410   -5.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9410   -6.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0749   -6.6750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8070   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6730   -6.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5391   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5391   -7.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6731   -8.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8070   -7.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0750   -3.6750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3429   -7.6750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6109   -6.6750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  1  2  0     0  0
  2  7  1  0     0  0
  7  8  1  0     0  0
  8  9  2  0     0  0
  9 10  1  0     0  0
 10  3  1  0     0  0
  9 11  1  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 11  2  0     0  0
  7 17  2  0     0  0
  4 18  1  0     0  0
  5 19  1  0     0  0
M  END
> <LM_ID>
LMPK12113415

> <COMMON_NAME>
7,8-dihydroxyflavone

> <SYSTEMATIC_NAME>
7,8-bis(oxidanyl)-2-phenyl-chromen-4-one

> <FORMULA>
C15H10O4

> <MASS>
254.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Tropoflavin

> <INCHI_KEY>
COCYGNDCWFKTMF-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H10O4/c16-11-7-6-10-12(17)8-13(19-15(10)14(11)18)9-4-2-1-3-5-9/h1-8,16,18H

> <SMILES>
C1=CC(O)=C(O)C2OC(C3=CC=CC=C3)=CC(=O)C1=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
140464

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
1880

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
429669

> <CITATION>
33348871

$$$$