LMPK12090045
  LIPID_MAPS_STRUCTURE_DATABASE

 27 31  0  0  0  0  0  0  0  0999 V2000
    5.6760    8.0179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6760    7.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3521    6.8470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0281    7.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0281    8.0179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3521    8.4082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7041    6.8470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3801    7.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3801    8.0179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7041    8.4082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0559    6.8471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0559    6.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7788    5.5952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5016    6.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5016    6.8471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7788    7.2645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7113    6.0128    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1776    5.6222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0562    8.4082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3521    6.0667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.8470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6760    5.6760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2857    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0664    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    8.4082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    9.6234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 26 27  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  2  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  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  1  0  0  0  0
  1  2  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  1  0  0  0  0
  9 19  2  0  0  0  0
  3 20  1  0  0  0  0
 21  2  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 20  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
  1 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12090045

> <COMMON_NAME>
Isoglycyrol

> <SYSTEMATIC_NAME>


> <FORMULA>
C21H18O6

> <MASS>
366.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Coumestan flavonoids [PK1209]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FLIECANP0001

> <PUBCHEM_COMPOUND_ID>
5318570

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12090045

$$$$