LMPK12140061
  LIPID_MAPS_STRUCTURE_DATABASE

 20 22  0     0  0            999 V2000
    7.5934    8.5962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5934    7.6014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4549    7.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3164    7.6014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3164    8.5962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4549    9.0936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1778    7.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0391    7.6014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0391    8.5962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1778    9.0936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9002    9.0932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7854    8.5822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6709    9.0932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6709   10.1156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7854   10.6268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9002   10.1156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0391    9.7677    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.0932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5543   10.6257    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1778    6.3595    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
  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  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  1  0  0  0
  1 18  1  0  0  0  0
 14 19  1  0  0  0  0
  7 20  2  0  0  0  0
M  END
> <LM_ID>
LMPK12140061

> <COMMON_NAME>
Liquiritigenin

> <SYSTEMATIC_NAME>
(S)-2,3-Dihydro-7-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

> <FORMULA>
C15H12O4

> <MASS>
256.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
4',7-Dihydroxyflavanone

> <INCHI_KEY>
FURUXTVZLHCCNA-AWEZNQCLSA-N

> <INCHI>
InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-7,14,16-17H,8H2/t14-/m0/s1

> <SMILES>
C1(O)C=C2O[C@]([H])(C3C=CC(O)=CC=3)CC(=O)C2=CC=1

> <KEGG_ID>
C09762

> <HMDB_ID>
-

> <CHEBI_ID>
28777

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
114829

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3827

> <CITATION>
-

$$$$