LMPK12050303
  LIPID_MAPS_STRUCTURE_DATABASE

 31 33  0     0  0            999 V2000
    7.5757    9.0828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5757    8.1091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4190    7.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2624    8.1091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2624    9.0828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4190    9.5698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1056    7.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9489    8.1091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9489    9.0828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1056    9.5698    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7919    7.6223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7919    6.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6937    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5954    6.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5954    7.6223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6937    8.1430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4190    6.6489    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1056    6.6489    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4961    8.1425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4961    6.0611    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3968    7.6223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4190   10.5431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5759   11.0299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5759   12.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4190   12.4900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7330   12.4900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.5696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2977    8.1425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2977    9.1826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1984    7.6223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6937    9.1831    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
  3 17  1  0  0  0  0
  7 18  2  0  0  0  0
 15 19  1  0  0  0  0
 14 20  1  0  0  0  0
 19 21  1  0  0  0  0
  6 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
  1 27  1  0  0  0  0
 21 28  2  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 16 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050303

> <COMMON_NAME>
2'-Hydroxyisolupalbigenin

> <SYSTEMATIC_NAME>
5,7,2',4'-Tetrahydroxy-8,3'-diprenylisoflavone

> <FORMULA>
C25H26O6

> <MASS>
422.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
VHWHNZUORPFYQI-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H26O6/c1-13(2)5-7-16-19(26)10-9-15(23(16)29)18-12-31-25-17(8-6-14(3)4)20(27)11-21(28)22(25)24(18)30/h5-6,9-12,26-29H,7-8H2,1-4H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14237659

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3870

> <CITATION>
-

$$$$