LMPK12070044
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0  0  0  0            999 V2000
    8.9775   -5.0106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9775   -5.9523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7931   -6.4233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6087   -5.9523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6087   -5.0106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7931   -4.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4243   -6.4233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2399   -5.9523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2399   -5.0106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4243   -4.5396    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0551   -6.4230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0551   -7.4299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9272   -7.9334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7993   -7.4299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7993   -6.4230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9272   -5.9196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4268   -7.4296    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1622   -4.5398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7931   -3.5983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9778   -3.1275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9778   -2.1861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1625   -1.7156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7931   -1.7156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9272   -8.9394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7983   -9.4423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7983  -10.4463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9290  -10.9481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6678  -10.9481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6704   -7.9329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9038   -5.4679    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7503   -6.8414    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  1  2  0     0  0
  4  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  5  1  0     0  0
  8 11  1  0     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 11  1  0     0  0
  7 17  1  0     0  0
 12 17  1  0     0  0
  1 18  1  0     0  0
  6 19  1  0     0  0
 19 20  1  0     0  0
 20 21  2  0     0  0
 21 22  1  0     0  0
 21 23  1  0     0  0
 13 24  1  0     0  0
 24 25  1  0     0  0
 25 26  2  0     0  0
 26 27  1  0     0  0
 26 28  1  0     0  0
 14 29  1  0     0  0
  8 30  1  6     0  0
  7 31  1  6     0  0
M  END
> <LM_ID>
LMPK12070044

> <COMMON_NAME>
Erybraedin A

> <SYSTEMATIC_NAME>
(6aR,11aR)-3,9-Dihydroxy-4,10-diprenylpterocarpan

> <FORMULA>
C25H28O4

> <MASS>
392.20

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Pterocarpans [PK1207]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
4-Prenylphaseollidin

> <INCHI_KEY>
HOGHBEDTLGAJAS-CPJSRVTESA-N

> <INCHI>
InChI=1S/C25H28O4/c1-14(2)5-7-17-21(26)12-10-19-23(17)28-13-20-16-9-11-22(27)18(8-6-15(3)4)24(16)29-25(19)20/h5-6,9-12,20,25-27H,7-8,13H2,1-4H3/t20-,25-/m0/s1

> <SMILES>
C1(O)=C(C/C=C(\C)/C)C2OC[C@@]3([H])C4C=CC(O)=C(C/C=C(/C)\C)C=4O[C@@]3([H])C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0038872

> <CHEBI_ID>
65862

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21141346

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2708827

> <CITATION>
-

$$$$