LMPK12070026
  LIPID_MAPS_STRUCTURE_DATABASE

 29 33  0  0  0  0  0  0  0  0999 V2000
    7.5543    9.6569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5543    8.7077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3762    8.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1982    8.7077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1982    9.6569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3762   10.1315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0202    8.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8422    8.7077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8422    9.6569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0202   10.1315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6639    8.2334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6639    7.2186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5426    6.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4215    7.2186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4215    8.2334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5426    8.7408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0227    7.2189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2996    6.7116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   10.1312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3762   11.0803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5545   11.5547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5545   12.5034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7328   12.9779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3762   12.9779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1793    7.2186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1793    8.2334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3004    8.7408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1793    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9948    7.6893    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
 14 18  1  0  0  0  0
  1 19  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 18 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 15  1  0  0  0  0
 25 28  1  0  0  0  0
 25 29  1  0  0  0  0
M  END
> <LM_ID>
LMPK12070026

> <COMMON_NAME>
Erybraedin D

> <SYSTEMATIC_NAME>
3-Hydroxy-4-prenyl-6'',6''-dimethylpyrano[2'',3'':9,8]pterocarpan

> <FORMULA>
C25H26O4

> <MASS>
390.18

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Pterocarpans [PK1207]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZWEQONVPSDWALR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H26O4/c1-14(2)5-6-16-20(26)8-7-17-23(16)27-13-19-18-11-15-9-10-25(3,4)29-21(15)12-22(18)28-24(17)19/h5,7-12,19,24,26H,6,13H2,1-4H3

> <SMILES>
C1(O)=C(C/C=C(\C)/C)C2OCC3C4C=C5C=CC(C)(C)OC5=CC=4OC3C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
471689

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3841

> <CITATION>
8590641

$$$$