LMPK12050134
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0     0  0            999 V2000
    7.5636    9.3386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5636    8.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3945    7.8995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2255    8.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2255    9.3386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3945    9.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0564    7.8995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8873    8.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8873    9.3386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0564    9.8183    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    9.8183    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7182    7.8995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7182    6.8737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6067    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4951    6.8737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4951    7.8995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6067    8.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0564    6.9400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3945   10.7777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3260    6.3939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6197    7.1407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  8 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  7 18  2  0  0  0  0
  6 19  1  0  0  0  0
 15 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050134

> <COMMON_NAME>
Retusin(Dalbergia)

> <SYSTEMATIC_NAME>
7,8-Dihydroxy-4'-methoxyisoflavone

> <FORMULA>
C16H12O5

> <MASS>
284.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DLXIJJURUIXRFK-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C16H12O5/c1-20-10-4-2-9(3-5-10)12-8-21-16-11(14(12)18)6-7-13(17)15(16)19/h2-8,17,19H,1H3

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0141945

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5481240

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 466221

> <CITATION>
-

$$$$