KEGG   COMPOUND: C12125Help
Entry
C12125                      Compound                               

Name
Isoformononetin;
4'-Hydroxy-7-methoxyisoflavone
Formula
C16H12O4
Exact mass
268.0736
Mol weight
268.2641
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Isoflavonoid biosynthesis
Biosynthesis of phenylpropanoids
Enzyme
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1205 Isoflavonoids
    C12125  Isoformononetin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Isoflavonoids
   Isoflavones
    C12125  Isoformononetin
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
ChEMBL: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        20
            1   C8y C    25.2064  -15.2068
            2   C8x C    25.2064  -16.6074
            3   C8x C    26.4232  -17.3042
            4   C8x C    26.4232  -14.5028
            5   C8y C    27.6331  -15.2068
            6   C8y C    27.6272  -16.6074
            7   C8y C    28.8383  -17.3094
            8   C8y C    30.0551  -16.6177
            9   C8x C    30.0611  -15.2171
            10  O2x O    28.8503  -14.5081
            11  C8y C    31.2661  -17.3197
            12  C8x C    31.2531  -18.7190
            13  C8x C    32.4642  -19.4280
            14  C8y C    33.6742  -18.7293
            15  C8x C    33.6801  -17.3285
            16  C8x C    32.4762  -16.6265
            17  O1a O    34.8851  -19.4383
            18  O5x O    28.8323  -18.7102
            19  O2a O    23.9999  -14.5023
            20  C1a C    22.7855  -15.2056
BOND        22
            1     9  10 1
            2    10   5 1
            3     8  11 1
            4     1   2 2
            5     2   3 1
            6     3   6 2
            7     5   4 2
            8     4   1 1
            9    11  12 2
            10   12  13 1
            11   13  14 2
            12   14  15 1
            13   15  16 2
            14   16  11 1
            15    5   6 1
            16   14  17 1
            17    6   7 1
            18    7  18 2
            19    7   8 1
            20    1  19 1
            21    8   9 2
            22   19  20 1

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