LMPK12120182
  LIPID_MAPS_STRUCTURE_DATABASE

 22 23  0     0  0            999 V2000
    7.8043    8.8769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8043    7.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6760    7.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5479    7.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5479    8.8769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6760    9.3803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4198    7.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2917    7.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1632    7.3670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0347    7.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9139    7.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7931    7.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7931    8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9139    9.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0347    8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4198    6.5810    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9327    9.3799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6760    6.3604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6722    9.3928    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6722    7.3626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9324    7.3667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    7.8701    0.0000 C   0  0  0  0  0  0  0  0  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
  1 17  1  0  0  0  0
  3 18  1  0  0  0  0
 13 19  1  0  0  0  0
 12 20  1  0  0  0  0
  2 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120182

> <COMMON_NAME>
Lanceoletin

> <SYSTEMATIC_NAME>
(E)-3'-Methoxy-2',3,4,4'-tetrahydroxychalcone

> <FORMULA>
C16H14O6

> <MASS>
302.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PBTMZSWZVLUWGV-GORDUTHDSA-N

> <INCHI>
InChI=1S/C16H14O6/c1-22-16-13(19)7-4-10(15(16)21)11(17)5-2-9-3-6-12(18)14(20)8-9/h2-8,18-21H,1H3/b5-2+

> <SMILES>
C1(O)=CC=C(C(=O)/C=C/C2C=CC(O)=C(O)C=2)C(O)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607581

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 159656

> <CITATION>
-

$$$$