LMPK12070122
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0  0  0  0  0  0  0  0999 V2000
    8.5257   12.3535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5257   11.4030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3490   10.9278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1722   11.4030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1722   12.3535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3490   12.8288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9953   10.9278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8185   11.4030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8185   12.3535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9953   12.8288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6414   10.9279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6414    9.9116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5216    9.4034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4018    9.9116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4018   10.9279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5216   11.4361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9979    9.9119    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6414   11.8781    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6094   12.8825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2810    9.4039    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5216    8.3882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4008    7.8805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4008    6.8672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5233    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2784    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7028   10.9279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7028    9.9797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8817    9.5057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8817    8.5575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.9797    0.0000 C   0  0  0  0  0  0  0  0  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  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  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  1  0  0  0  0
 12 17  1  0  0  0  0
  8 18  1  0  0  0  0
 19  1  1  0  0  0  0
 14 20  1  0  0  0  0
 13 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
  2 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12070122

> <COMMON_NAME>
2-Prenyl-6a-hydroxyphaseollidin

> <SYSTEMATIC_NAME>
3,6a,9-Trihydroxy-2,10-diprenylpterocarpan

> <FORMULA>
C25H28O5

> <MASS>
408.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Pterocarpans [PK1207]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZAAKSBRPXNODLV-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H28O5/c1-14(2)5-7-16-11-18-22(12-21(16)27)29-13-25(28)19-9-10-20(26)17(8-6-15(3)4)23(19)30-24(18)25/h5-6,9-12,24,26-28H,7-8,13H2,1-4H3

> <SMILES>
C1(O)=CC2OCC3(O)C4C=CC(O)=C(C/C=C(/C)\C)C=4OC3C=2C=C1C/C=C(\C)/C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257484

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3884

> <CITATION>
-

$$$$