LMPK12120555
  LIPID_MAPS_STRUCTURE_DATABASE

 22 23  0  0  0  0  0  0  0  0999 V2000
    5.6847    6.9800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6847    6.1872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3714    5.7907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0580    6.1872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0581    6.9800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3714    7.3764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7428    5.7918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4276    6.1872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1123    5.7918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7971    6.1872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4643    5.8020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1316    6.1872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1316    6.9576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4643    7.3429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7971    6.9576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7428    5.0011    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3714    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7428    7.3754    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3714    8.1671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4448    8.7867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.3754    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    8.6147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  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
  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
  5 18  1  0  0  0  0
  1 21  1  0  0  0  0
  6 19  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120555

> <COMMON_NAME>
Dihydropashanone

> <SYSTEMATIC_NAME>


> <FORMULA>
C17H18O5

> <MASS>
302.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
JIPRVIMCAIKNJN-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H18O5/c1-21-14-10-13(19)15(16(20)17(14)22-2)12(18)9-8-11-6-4-3-5-7-11/h3-7,10,19-20H,8-9H2,1-2H3

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0133984

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
179533

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$