LMPK12060062
  LIPID_MAPS_STRUCTURE_DATABASE

 29 33  0     0  0            999 V2000
    7.8269   10.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8269    9.6632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6598    9.1823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4928    9.6632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4928   10.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6598   11.1060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3257    9.1823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1586    9.6632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1586   10.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3257   11.1060    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9912    9.1826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9912    8.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8818    7.6400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7723    8.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7723    9.1826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8818    9.6966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3257    8.2208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9222   10.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9916   11.1060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4598   12.0467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5034   12.1473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1122   11.2687    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0225   12.9803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5034   13.8133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   12.9803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8818    6.6785    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9516    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6053    7.6735    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9020    8.4221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 26 27  1  0  0  0  0
 28 29  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  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
  7 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19  9  1  0  0  0  0
  1  2  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22  1  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 14 28  1  0  0  0  0
 13 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12060062

> <COMMON_NAME>
Dehydrorotenone

> <SYSTEMATIC_NAME>
(R)-1,2-Dihydro-8,9-dimethoxy-2-(1-methylethenyl)-[1]benzopyrano[3,4-b]furo[2,3-h][1]benzopyran-6(12H)-one

> <FORMULA>
C23H20O6

> <MASS>
392.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Rotenoid flavonoids [PK1206]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Didehydrorotenone, 6a,12a-Dehydrorotenone

> <INCHI_KEY>
GFERNZCCTZEIET-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C23H20O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16H,1,8,10H2,2-4H3

> <SMILES>
C12OC(C(C)=C)CC=1C1OC3COC4=C(C=C(OC)C(OC)=C4)C=3C(=O)C=1C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
110163

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
303993

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1096003

> <CITATION>
-

$$$$