LMPK12110731
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0  0  0  0  0  0  0  0999 V2000
    9.3471    7.8702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3471    8.8765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4758    9.3796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6041    8.8765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6041    7.8702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4758    7.3669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2188    7.3669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0903    7.8702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0903    8.8766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2188    9.3796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9617    9.3798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8333    8.8766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7048    9.3798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7048   10.3862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8333   10.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9617   10.3862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2188    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4758    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5762    8.8766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4479    9.3798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4479   10.3862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5762   10.8893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4389   10.2114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7921   11.3317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8333   11.7114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.3796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  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  2  1  0  0  0  0
  9 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  2  0  0  0  0
  6 18  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 14  1  0  0  0  0
 21 23  1  0  0  0  0
 21 24  1  0  0  0  0
 15 25  1  0  0  0  0
  4 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110731

> <COMMON_NAME>
Yinyanghuo E

> <SYSTEMATIC_NAME>
5,7-Dihydroxy-2-(8-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-4H-1-benzopyran-4-one

> <FORMULA>
C20H16O6

> <MASS>
352.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FIKLOAGOJKGOFT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H16O6/c1-20(2)4-3-10-5-11(6-15(24)19(10)26-20)16-9-14(23)18-13(22)7-12(21)8-17(18)25-16/h3-9,21-22,24H,1-2H3

> <SMILES>
C12C(=O)C=C(C3C=C(O)C4OC(C)(C)C=CC=4C=3)OC=1C=C(O)C=C2O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5315397

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 253616

> <CITATION>
-

$$$$