LMPK12050428
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0     0  0            999 V2000
    7.5706    9.0639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5706    8.0963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4085    7.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2463    8.0963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2463    9.0639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4085    9.5477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0843    7.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9222    8.0963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9222    9.0639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0843    9.5477    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7601    7.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7601    6.5778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6560    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5519    6.5778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5519    7.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6560    8.1296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0843    6.6449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4085    6.6449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.5477    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3900    6.0941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2279    6.5778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0659    6.0941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9039    6.5778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9039    7.5455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7419    6.0941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4085   10.5153    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7129   11.2683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 26 27  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
  8 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  0
  1 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
  6 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050428

> <COMMON_NAME>
Aurmillone

> <SYSTEMATIC_NAME>
5,7-Dihydroxy-8-methoxy-4'-prenyloxyisoflavone

> <FORMULA>
C21H20O6

> <MASS>
368.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
TVYVWMVAJHMVLX-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H20O6/c1-12(2)8-9-26-14-6-4-13(5-7-14)15-11-27-21-18(19(15)24)16(22)10-17(23)20(21)25-3/h4-8,10-11,22-23H,9H2,1-3H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257365

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 53625

> <CITATION>
-

$$$$