LMPK12020180
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0  0  0  0  0  0  0  0999 V2000
    6.1635    7.2961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1635    6.4766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8733    6.0668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5831    6.4766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5831    7.2961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8733    7.7059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2929    6.0668    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0027    6.4766    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0027    7.2961    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.2929    7.7059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7122    7.7058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4356    7.2882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1590    7.7058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1590    8.5412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4356    8.9588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7122    8.5412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2929    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.8446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8822    8.9586    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7122    6.0669    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4356    9.7939    0.0000 O   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
  9 11  1  6  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  6  0  0  0
 18  1  1  0  0  0  0
 14 19  1  0  0  0  0
  8 20  1  6  0  0  0
 15 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020180

> <COMMON_NAME>
Epifisetinidol-4alpha-ol

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H14O6

> <MASS>
290.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavans, Flavanols and Leucoanthocyanidins [PK1202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OFZBQQUVMQGHDJ-RBSFLKMASA-N

> <INCHI>
InChI=1S/C15H14O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,13-20H/t13-,14-,15-/m1/s1

> <SMILES>
C1(O)=CC2O[C@H](C3C=C(O)C(O)=CC=3)[C@H](O)[C@H](O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
196285

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12305024

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$