LMPK12140074
  LIPID_MAPS_STRUCTURE_DATABASE

 27 30  0  0  0  0  0  0  0  0999 V2000
    7.7910    8.6998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8136    7.7209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7601    7.2518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5576    7.7403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5750    8.7449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6911    9.2625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4770    7.2221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2976    7.7104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2865    8.7655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4535    9.2322    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1566    9.2678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9983    8.7971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8598    9.2742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8950   10.2773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0226   10.8104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1454   10.3230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4770    6.3187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7652   10.7796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6436   10.2724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6539   10.3233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7165   10.8215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8165   10.2589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8537    9.1981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2709   10.8044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7299    8.7719    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5928    9.2701    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
  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  5  1  0  0  0  0
  9 11  1  6  0  0  0
 11 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 11  1  0  0  0  0
  7 17  2  0  0  0  0
 18 14  1  0  0  0  0
 18 19  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23  1  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
 13 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140074

> <COMMON_NAME>
Ponganone III

> <SYSTEMATIC_NAME>
(2S)-3',4'-Dimethoxy-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone

> <FORMULA>
C22H22O5

> <MASS>
366.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WBKMMUGBIOVPMR-IBGZPJMESA-N

> <INCHI>
InChI=1S/C22H22O5/c1-22(2)10-9-15-17(27-22)8-6-14-16(23)12-19(26-21(14)15)13-5-7-18(24-3)20(11-13)25-4/h5-11,19H,12H2,1-4H3/t19-/m0/s1

> <SMILES>
C12OC(C)(C)C=CC=1C1O[C@H](C3C=CC(OC)=C(OC)C=3)CC(=O)C=1C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15160702

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 56065

> <CITATION>
-

$$$$