KEGG   COMPOUND: C09762
Entry
C09762                      Compound                               

Name
Liquiritigenin;
4',7-Dihydroxyflavanone
Formula
C15H12O4
Exact mass
256.0736
Mol weight
256.2534
Structure
Reaction
Pathway
map00941  Flavonoid biosynthesis
map00943  Isoflavonoid biosynthesis
map01061  Biosynthesis of phenylpropanoids
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.11.9       1.14.13.-       1.14.14.82      1.14.14.87      
1.14.14.162     1.14.19.76      1.14.20.5       5.5.1.6
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1214 Flavanones
    C09762  Liquiritigenin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavanones
    C09762  Liquiritigenin
Other DBs
CAS: 578-86-9
PubChem: 11950
ChEBI: 28777
ChEMBL: CHEMBL252642
KNApSAcK: C00000977
PDB-CCD: DFV[PDBj]
3DMET: B03260
NIKKAJI: J22.604A
KCF data

ATOM        19
            1   C8y C    22.1272  -14.8909
            2   C8y C    22.1213  -16.2946
            3   O2x O    23.3445  -14.1920
            4   C8x C    20.9217  -14.1863
            5   C5x C    23.3328  -16.9935
            6   C8x C    20.9217  -16.9876
            7   C1y C    24.5500  -14.9026
            8   C8y C    19.7044  -14.8909
            9   C1x C    24.5441  -16.3003
            10  O5x O    23.3269  -18.3911
            11  C8x C    19.7044  -16.2946
            12  O1a O    18.4872  -14.1863
            13  C8y C    25.7673  -14.2037
            14  C8x C    26.9727  -14.9142
            15  C8x C    25.7673  -12.8059
            16  C8x C    28.1899  -14.2153
            17  C8x C    26.9843  -12.1129
            18  C8y C    28.1958  -12.8176
            19  O1a O    29.4130  -12.1246
BOND        21
            1     4   8 2
            2     5   9 1
            3     5  10 2
            4     6  11 2
            5     8  12 1
            6     7   9 1
            7     8  11 1
            8     7  13 1 #Down
            9     1   2 2
            10    1   3 1
            11    1   4 1
            12    2   5 1
            13    2   6 1
            14    3   7 1
            15   13  14 2
            16   13  15 1
            17   14  16 1
            18   15  17 2
            19   16  18 2
            20   18  19 1
            21   17  18 1

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