LMPK12050473
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    7.1013    8.4839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1013    7.6730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8034    7.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5056    7.6730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5056    8.4839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8034    8.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2078    7.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9100    7.6730    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.9100    8.4839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2078    8.8893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6119    7.2677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6119    6.4008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3627    5.9674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1135    6.4008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1135    7.2677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3627    7.7012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2078    6.4531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3993    8.8891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8034    6.4571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3993    7.2677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3993    6.4590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6989    6.0546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6989    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8635    5.9679    0.0000 O   0  0  0  0  0  0  0  0  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
  8 11  1  0  0  0  0
 11 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 11  2  0  0  0  0
  1  2  1  0  0  0  0
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
  2 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 14 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050473

> <COMMON_NAME>
(+)-Dihydrowighteone

> <SYSTEMATIC_NAME>
(+)-5,7,4'-Trihydroxy-6-prenylisoflavanone

> <FORMULA>
C20H20O5

> <MASS>
340.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
UYDQKAKPHFFLDY-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H20O5/c1-11(2)3-8-14-16(22)9-17-18(19(14)23)20(24)15(10-25-17)12-4-6-13(21)7-5-12/h3-7,9,15,21-23H,8,10H2,1-2H3

> <SMILES>
C1(O)C(C/C=C(\C)/C)=C(O)C2C(=O)C(C3=CC=C(O)C=C3)COC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186073

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257383

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$