LMPK12120055
  LIPID_MAPS_STRUCTURE_DATABASE

 29 31  0  0  0  0  0  0  0  0999 V2000
   14.4467    7.0069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4467    6.1928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1517    5.7857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8567    6.1928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8567    7.0069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1517    7.4139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0106    6.2189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7156    5.8118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3058    5.8121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5948    6.2349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3058    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5948    7.0435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8945    7.4479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1942    7.0435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1942    6.2349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8945    5.8305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8945    5.0219    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5615    7.4137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4938    7.4479    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7935    7.0435    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.7935    6.2349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4938    5.8305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7935    7.8695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0333    6.6047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2742    7.0429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5152    6.6047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7576    7.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.6047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7576    7.9168    0.0000 C   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
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
  2  8  1  0  0  0  0
 10 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 10  1  0  0  0  0
 16 17  1  0  0  0  0
  5 18  1  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 15  1  0  0  0  0
 20 23  1  0  0  0  0
 20 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120055

> <COMMON_NAME>
Lespeol

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H26O4

> <MASS>
390.18

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PTLYOYNZZDSYSJ-XYOKQWHBSA-N

> <INCHI>
InChI=1S/C25H26O4/c1-17(2)5-4-15-25(3)16-14-21-23(29-25)13-11-20(24(21)28)22(27)12-8-18-6-9-19(26)10-7-18/h5-14,16,26,28H,4,15H2,1-3H3/b12-8+

> <SMILES>
C1=CC(O)=CC=C1/C=C/C(=O)C1C(O)=C2C=CC(CC/C=C(\C)/C)(C)OC2=CC=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
23259405

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$