LMPK12120489
  LIPID_MAPS_STRUCTURE_DATABASE

 22 23  0  0  0  0  0  0  0  0999 V2000
    5.7207    7.0815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7207    6.2486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4420    5.8322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1631    6.2486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1631    7.0815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4420    7.4978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4420    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8838    5.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6026    6.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3214    5.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0404    6.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7592    5.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4780    6.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4780    7.0776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7592    7.4926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0404    7.0776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8838    5.0025    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1276    7.4240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8838    7.4975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4420    8.3299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7213    8.7461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  8 17  2  0  0  0  0
  1 18  1  0  0  0  0
  5 19  1  0  0  0  0
  2 20  1  0  0  0  0
  6 21  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
> <LM_ID>
LMPK12120489

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3'-Formyl-2',4',6'-trihydroxy-5'-methyldihydrochalcone

> <FORMULA>
C17H16O5

> <MASS>
300.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HKKGGXRAYMJKFW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H16O5/c1-10-15(20)12(9-18)17(22)14(16(10)21)13(19)8-7-11-5-3-2-4-6-11/h2-6,9,20-22H,7-8H2,1H3

> <SMILES>
C1(O)C(C=O)=C(O)C(C(=O)CCC2C=CC=CC=2)=C(O)C=1C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11033908

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$