LMPK12060056
  LIPID_MAPS_STRUCTURE_DATABASE

 24 27  0     0  0            999 V2000
    6.8957    9.0535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8957    8.0893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7309    7.6070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5660    8.0893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5660    9.0535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7309    9.5357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4013    7.6070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2365    8.0893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2365    9.0535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4013    9.5357    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0712    7.6072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0712    6.5761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9642    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8572    6.5761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8572    7.6072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9642    8.1228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0712    9.5356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4013    6.6426    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9739    9.0535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2365    7.1248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6924    8.0894    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7309    6.6426    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.5356    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   11.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 23 24  1  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
  9 17  1  0  0  0  0
  7 18  2  0  0  0  0
 16 19  1  0  0  0  0
 19 17  1  0  0  0  0
  8 20  1  0  0  0  0
 15 21  1  0  0  0  0
  3 22  1  0  0  0  0
  1 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12060056

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
(-)-4,11,12a-Trihydroxy-9-methoxyrotenone

> <FORMULA>
C17H14O7

> <MASS>
330.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Rotenoid flavonoids [PK1206]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZXZFBFOIMQWFPM-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O7/c1-22-8-5-11(19)14-12(6-8)24-13-7-23-15-9(3-2-4-10(15)18)17(13,21)16(14)20/h2-6,13,18-19,21H,7H2,1H3

> <SMILES>
C1(OC)=CC2OC3COC4C(=CC=CC=4O)C3(O)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21676233

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 122400

> <CITATION>
-

$$$$