LMPK12120383
  LIPID_MAPS_STRUCTURE_DATABASE

 23 24  0  0  0  0  0  0  0  0999 V2000
    5.7205    7.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7205    6.2483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4415    5.8321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1624    6.2483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1624    7.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4415    7.4970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8833    5.8321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6042    6.2483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3248    5.8322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0453    6.2483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7723    5.8286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4993    6.2483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4993    7.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7723    7.5075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0453    7.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8833    5.1825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4415    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3248    5.0019    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.4967    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4415    8.3291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8829    7.4967    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8761    8.8943    0.0000 O   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  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 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 10  1  0  0  0  0
  7 16  2  0  0  0  0
  3 17  1  0  0  0  0
  9 18  2  0  0  0  0
  1 19  1  0  0  0  0
  6 20  1  0  0  0  0
  5 21  1  0  0  0  0
  2 22  1  0  0  0  0
 20 23  2  0  0  0  0
M  END
> <LM_ID>
LMPK12120383

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3'-Formyl-2',4',6',beta-tetrahydroxy-5'-methylchalcone

> <FORMULA>
C17H14O6

> <MASS>
314.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QPVZZWBDGFERFN-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O6/c1-9-15(21)11(8-18)17(23)14(16(9)22)13(20)7-12(19)10-5-3-2-4-6-10/h2-6,8,21-23H,7H2,1H3

> <SMILES>
C1(O)=C(C=O)C(O)=C(C(=O)CC(=O)C2C=CC=CC=2)C(O)=C1C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607645

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$