LMPK12050206
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0  0  0  0  0  0  0  0999 V2000
    7.0473    7.4918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0473    6.6889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7426    6.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4378    6.6889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4378    7.4918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7426    7.8933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1331    6.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8284    6.6889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8284    7.4918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1331    7.8933    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5235    6.2876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5235    5.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2669    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0103    5.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0103    6.2876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2669    6.7168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7530    5.0005    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3520    7.8933    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6567    7.4918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6567    6.6889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3520    6.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6567    8.4211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.1126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7426    5.4849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4941    5.4285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2353    5.0005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9765    5.4285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9765    6.2825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7162    5.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1331    5.4849    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  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  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
 14 17  1  0  0  0  0
  1 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21  2  1  0  0  0  0
 19 22  1  0  0  0  0
 19 23  1  0  0  0  0
  3 24  1  0  0  0  0
 17 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
  7 30  2  0  0  0  0
M  END
> <LM_ID>
LMPK12050206

> <COMMON_NAME>
4'-O-Prenylalpinumisoflavone

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H24O5

> <MASS>
404.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OHVOXMFXCZKNPR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H24O5/c1-15(2)10-12-28-17-7-5-16(6-8-17)19-14-29-21-13-20-18(9-11-25(3,4)30-20)23(26)22(21)24(19)27/h5-11,13-14,26H,12H2,1-4H3

> <SMILES>
C12OC(C)(C)C=CC1=C(O)C1C(=O)C(C3=CC=C(OC/C=C(/C)\C)C=C3)=COC=1C=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5459223

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$