KEGG   COMPOUND: C08650Help
Entry
C08650                      Compound                               

Name
Isoliquiritigenin
Formula
C15H12O4
Exact mass
256.0736
Mol weight
256.2534
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Flavonoid biosynthesis
Biosynthesis of phenylpropanoids
Biosynthesis of secondary metabolites
Enzyme
2.1.1.154       2.3.1.170       5.5.1.6
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1212 Chalcones and dihydrochalcones
    C08650  Isoliquiritigenin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Chalcones
    C08650  Isoliquiritigenin
BRITE hierarchy
Other DBs
CAS: 
961-29-5
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        19
            1   C8y C    26.4861  -17.7079
            2   C5a C    27.6973  -18.4010
            3   C8y C    25.2748  -18.4010
            4   C8x C    26.4861  -16.3044
            5   C2b C    28.9029  -17.7021
            6   O5a O    27.6973  -19.7987
            7   C8x C    24.0577  -17.7079
            8   O1a O    25.2748  -19.8044
            9   C8x C    25.2748  -15.5998
            10  C8y C    24.0577  -16.3044
            11  O1a O    22.8462  -15.5998
            12  C2b C    30.1253  -18.4050
            13  C8y C    31.3153  -17.7149
            14  C8x C    32.5078  -18.4006
            15  C8x C    33.7190  -17.6984
            16  C8y C    33.7165  -16.2985
            17  C8x C    32.5240  -15.6128
            18  C8x C    31.3128  -16.3149
            19  O1a O    34.9400  -15.5889
BOND        20
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     7  10 2
            10   10  11 1
            11    9  10 1
            12    5  12 2
            13   12  13 1
            14   13  14 2
            15   14  15 1
            16   15  16 2
            17   16  17 1
            18   17  18 2
            19   13  18 1
            20   16  19 1

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