KEGG   COMPOUND: C06563
Entry
C06563                      Compound                               

Name
Genistein;
5,7,4'-Trihydroxyisoflavone
Formula
C15H10O5
Exact mass
270.0528
Mol weight
270.2369
Structure
Remark
Same as: D11680
Reaction
Pathway
map00943  Isoflavonoid biosynthesis
map01061  Biosynthesis of phenylpropanoids
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.14.90      2.1.1.150       2.1.1.212       2.4.1.170       
4.2.1.105
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1205 Isoflavonoids
    C06563  Genistein
Phytochemical compounds [BR:br08003]
 Flavonoids
  Isoflavonoids
   Isoflavones
    C06563  Genistein
Other DBs
CAS: 446-72-0
PubChem: 8792
ChEBI: 28088
ChEMBL: CHEMBL44
KNApSAcK: C00002526
PDB-CCD: GEN[PDBj]
3DMET: B00974
NIKKAJI: J39.883G
KCF data

ATOM        20
            1   C8y C    27.0900  -15.1200
            2   C8y C    27.0900  -16.5200
            3   O2x O    28.2800  -14.4200
            4   C8x C    25.8300  -14.4200
            5   C8y C    28.2800  -17.2200
            6   C8y C    25.8300  -17.2200
            7   C8x C    29.4700  -15.1200
            8   C8y C    24.6400  -15.1200
            9   C8y C    29.4700  -16.5200
            10  O5x O    28.2800  -18.6900
            11  C8x C    24.6400  -16.5200
            12  O1a O    25.8300  -18.6900
            13  O1a O    23.4500  -14.4200
            14  C8y C    30.7300  -17.2900
            15  C8x C    30.7300  -18.7600
            16  C8x C    31.9200  -16.5900
            17  C8x C    31.9200  -19.4600
            18  C8x C    33.1100  -17.2900
            19  C8y C    33.1100  -18.7600
            20  O1a O    34.3000  -19.4600
BOND        22
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     5  10 2
            10    6  11 2
            11    6  12 1
            12    8  13 1
            13    9  14 1
            14   14  15 2
            15   14  16 1
            16   15  17 1
            17   16  18 2
            18   17  19 2
            19   19  20 1
            20    7   9 2
            21    8  11 1
            22   18  19 1

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