LMPK12140597
  LIPID_MAPS_STRUCTURE_DATABASE

 24 27  0  0  0  0  0  0  0  0999 V2000
    6.3461    7.4283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3461    6.5869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0748    6.1662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8034    6.5869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8034    7.4283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0748    7.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5321    6.1662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2608    6.5869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2608    7.4283    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5321    7.8490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0344    7.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7631    7.4543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4917    7.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4917    8.7164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7631    9.1371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0344    8.7164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5321    5.4258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6624    7.8231    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.4406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0748    5.4251    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4890    5.0868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2919    7.6149    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7865    8.2957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2919    8.9763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  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
  1 18  1  0  0  0  0
 18 19  1  0  0  0  0
  3 20  1  0  0  0  0
 20 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 14  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140597

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
(2S)-5,7-Dimethoxy-3',4'-methylenedioxyflavanone

> <FORMULA>
C18H16O6

> <MASS>
328.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MBVOWARNXXLUSL-AWEZNQCLSA-N

> <INCHI>
InChI=1S/C18H16O6/c1-20-11-6-16(21-2)18-12(19)8-14(24-17(18)7-11)10-3-4-13-15(5-10)23-9-22-13/h3-7,14H,8-9H2,1-2H3/t14-/m0/s1

> <SMILES>
C1(OC)C=C2O[C@H](C3C=CC4OCOC=4C=3)CC(=O)C2=C(OC)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10336604

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$