LMPK12140613
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0  0  0  0  0  0  0  0999 V2000
    6.8936    9.0824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8936    8.1208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7264    7.6400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5592    8.1208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5592    9.0824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7264    9.5632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3922    7.6400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2248    8.1208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2248    9.0824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3920    9.5632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0578    9.5632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9065    9.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7555    9.5632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7555   10.5435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9067   11.0334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0578   10.5435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3922    6.6782    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    7.6400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7264    6.6782    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7960    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    9.5632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607   11.0603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  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
  2 18  1  0  0  0  0
  3 19  1  0  0  0  0
  1 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140613

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
6-Hydroxy-5,7-dimethoxyflavanone

> <FORMULA>
C17H16O5

> <MASS>
300.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XVCRDIQXUUPWPZ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H16O5/c1-20-14-9-13-15(17(21-2)16(14)19)11(18)8-12(22-13)10-6-4-3-5-7-10/h3-7,9,12,19H,8H2,1-2H3

> <SMILES>
C1(OC)=CC2OC(C3C=CC=CC=3)CC(=O)C=2C(OC)=C1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42608096

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 130401

> <CITATION>
-

$$$$