LMPK12120201
  LIPID_MAPS_STRUCTURE_DATABASE

 32 34  0  0  0  0  0  0  0  0999 V2000
   12.2803    7.0549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2803    6.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9923    5.8218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7043    6.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7043    7.0549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9923    7.4660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6716    6.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3835    5.8218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9598    5.8219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2420    6.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9598    5.0018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2420    7.0656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5347    7.4740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8273    7.0656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8273    6.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5347    5.8405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5347    5.0239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4127    6.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1201    5.8405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9923    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7056    5.8406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7056    5.0259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5347    8.2906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8273    8.6990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1201    8.2906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1201    7.4740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4130    8.6989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8980    9.1193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5686    7.4659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9491    7.4738    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6565    7.0654    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
 18 19  1  0  0  0  0
 19 15  1  0  0  0  0
  3 20  1  0  0  0  0
 18 21  2  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
 13 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 14  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
  1 30  1  0  0  0  0
 12 31  1  0  0  0  0
 31 32  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120201

> <COMMON_NAME>
Orotinichalcone

> <SYSTEMATIC_NAME>


> <FORMULA>
C26H28O6

> <MASS>
436.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KUGIAZMVBJNSTD-VAWYXSNFSA-N

> <INCHI>
InChI=1S/C26H28O6/c1-15(2)9-10-17-23(30)22(21(29)12-11-16-19(27)7-6-8-20(16)28)25(31-5)18-13-14-26(3,4)32-24(17)18/h6-9,11-14,27-28,30H,10H2,1-5H3/b12-11+

> <SMILES>
C1(O)=CC=CC(O)=C1/C=C/C(=O)C1C(O)=C(C/C=C(/C)\C)C2OC(C)(C)C=CC=2C=1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186212

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21722046

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$