LMPK12140680
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
   10.1749   -5.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1749   -6.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0177   -7.0252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8606   -6.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8606   -5.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0177   -5.0789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7034   -7.0252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5461   -6.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5461   -5.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7034   -5.0789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3887   -5.0790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2477   -5.5749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1067   -5.0790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1067   -4.0872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2477   -3.5913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3887   -4.0872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7034   -7.8491    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0176   -8.0252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1516   -8.5252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3089   -7.0387    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4428   -6.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3089   -5.0655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3089   -4.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0176   -4.0789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8836   -3.5789    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  0  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
  3 18  1  0     0  0
 18 19  1  0     0  0
  2 20  1  0     0  0
 20 21  1  0     0  0
  1 22  1  0     0  0
 22 23  1  0     0  0
  6 24  1  0     0  0
 24 25  1  0     0  0
M  END
> <LM_ID>
LMPK12140680

> <COMMON_NAME>
Kanakugin

> <SYSTEMATIC_NAME>
5,6,7,8-tetramethoxyflavanone

> <FORMULA>
C19H20O6

> <MASS>
344.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
5,6,7,8-tetramethoxy-2-phenyl-2,3-dihydrochromen-4-one

> <INCHI_KEY>
MYURJYCFOUHXBP-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H20O6/c1-21-15-14-12(20)10-13(11-8-6-5-7-9-11)25-16(14)18(23-3)19(24-4)17(15)22-2/h5-9,13H,10H2,1-4H3

> <SMILES>
C1(OC)=C(OC)C2OC(C3C=CC=CC=3)CC(=O)C=2C(OC)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14136084

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2231804

> <CITATION>
-

$$$$