KEGG   COMPOUND: C14391
Entry
C14391                      Compound                               
Name
Diethylstilbestrol dimethyl ether;
(E)-1,1'-(1,2-Diethyl-1,2-ethenediyl)bis(4-methoxybenzene)
Formula
C20H24O2
Exact mass
296.1776
Mol weight
296.40
Structure
Other DBs
CAS: 7773-34-4
PubChem: 17395391
ChEBI: 34701
NIKKAJI: J48.676K
LinkDB
KCF data

ATOM        22
            1   C2c C    28.8756  -16.2788
            2   C2c C    28.8870  -17.6737
            3   C8y C    27.6558  -15.5843
            4   C1b C    30.0894  -15.5726
            5   C8y C    30.1011  -18.3740
            6   C1b C    27.6791  -18.3740
            7   C8x C    26.4417  -16.2788
            8   C8x C    27.6558  -14.1779
            9   C1a C    31.3033  -16.2672
            10  C8x C    30.1011  -19.7748
            11  C8x C    31.3150  -17.6678
            12  C1a C    26.4651  -17.6794
            13  C8x C    25.2279  -15.5843
            14  C8x C    26.4417  -13.4716
            15  C8x C    31.3209  -20.4751
            16  C8x C    32.5347  -18.3681
            17  C8y C    25.2279  -14.1779
            18  C8y C    32.5347  -19.7688
            19  O2a O    24.0081  -13.4716
            20  O2a O    33.7488  -20.4751
            21  C1a C    22.8206  -14.1555
            22  C1a C    34.9421  -19.7911
BOND        23
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     5  10 2
            10    5  11 1
            11    6  12 1
            12    7  13 1
            13    8  14 2
            14   10  15 1
            15   11  16 2
            16   13  17 2
            17   15  18 2
            18   17  19 1
            19   18  20 1
            20   14  17 1
            21   16  18 1
            22   19  21 1
            23   20  22 1

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