LMPK12120336
  LIPID_MAPS_STRUCTURE_DATABASE

 22 23  0  0  0  0  0  0  0  0999 V2000
    5.8731    6.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8731    6.1780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5531    5.7853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2332    6.1780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2332    6.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5531    7.3558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9132    5.7853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5933    6.1780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2733    5.7853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9534    6.1780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6392    5.7820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3250    6.1780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3250    6.9699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6392    7.3657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9534    6.9699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9132    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5531    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9132    7.3558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5531    8.1411    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6118    8.7522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.3558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.5782    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  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 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
  6 19  1  0  0  0  0
  1 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120336

> <COMMON_NAME>
Pashanone

> <SYSTEMATIC_NAME>


> <FORMULA>
C17H16O5

> <MASS>
300.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KVDNSLPRNTZIKF-CMDGGOBGSA-N

> <INCHI>
InChI=1S/C17H16O5/c1-21-14-10-13(19)15(16(20)17(14)22-2)12(18)9-8-11-6-4-3-5-7-11/h3-10,19-20H,1-2H3/b9-8+

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0133983

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6254251

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$