KEGG   COMPOUND: C14314
Entry
C14314                      Compound                               
Name
4',6,7-Trihydroxyisoflavone;
6-Hydroxydaidzein
Formula
C15H10O5
Exact mass
270.0528
Mol weight
270.2369
Structure
Reaction
R07716 R07717
Pathway
map00943  Isoflavonoid biosynthesis
map01110  Biosynthesis of secondary metabolites
Other DBs
CAS: 17817-31-1
PubChem: 17395314
ChEBI: 74957
LIPIDMAPS: LMPK12050102
KNApSAcK: C00009385
PDB-CCD: 674[PDBj]
NIKKAJI: J254.133E
LinkDB
KCF data

ATOM        20
            1   C8y C    24.5731  -15.3341
            2   C8x C    25.8285  -14.5669
            3   C8x C    25.8983  -17.4264
            4   C8y C    29.4553  -16.5895
            5   C8y C    24.5731  -16.7291
            6   C8y C    27.0840  -15.2643
            7   C8y C    27.0840  -16.6592
            8   C8y C    28.2698  -17.3566
            9   C8x C    29.4553  -15.2643
            10  O5x O    28.2695  -18.6819
            11  O2x O    28.1998  -14.5669
            12  O1a O    23.3484  -14.6472
            13  O1a O    23.3812  -17.4487
            14  C8y C    30.7063  -17.2699
            15  C8x C    30.7416  -18.6324
            16  C8x C    31.9684  -19.2989
            17  C8y C    33.1591  -18.5697
            18  C8x C    33.1936  -17.2073
            19  C8x C    31.8969  -16.5407
            20  O1a O    34.3787  -19.2734
BOND        22
            1     1   2 2
            2     1   5 1
            3     2   6 1
            4     3   5 2
            5     3   7 1
            6     4   8 1
            7     4   9 2
            8     6   7 2
            9     6  11 1
            10    7   8 1
            11    8  10 2
            12    9  11 1
            13    1  12 1
            14    5  13 1
            15    4  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   14  19 1
            22   17  20 1

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