KEGG   COMPOUND: C14621Help
Entry
C14621                      Compound                               

Name
9-Fluoro-17-methyl-11-oxotestosterone;
9alpha-Fluoro-17beta-hydroxy-17alpha-methylandrost-4-ene-3,11-dione
Formula
C20H27FO3
Exact mass
334.1944
Mol weight
334.425
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 465-69-0
PubChem: 17395621
ChEBI: 34510
ChEMBL: CHEMBL406406
NIKKAJI: J2.788.573J
LinkDB All DBs
KCF data Show

ATOM        24
            1   C1x C    18.6472  -24.4292
            2   C5x C    18.6472  -25.7894
            3   C2x C    19.8251  -26.4694
            4   C2y C    21.0030  -25.7894
            5   C1z C    21.0030  -24.4292
            6   C1x C    19.8251  -23.7492
            7   C1x C    22.1809  -26.4694
            8   C1x C    23.3588  -25.7894
            9   C1y C    23.3588  -24.4292
            10  C1z C    22.1809  -23.7492
            11  C1y C    24.5367  -23.7492
            12  C1z C    24.5367  -22.3891
            13  C1x C    23.3588  -21.7091
            14  C5x C    22.1809  -22.3891
            15  C1x C    26.8924  -23.7492
            16  C1x C    26.8924  -22.3891
            17  C1z C    25.7145  -21.7091
            18  X   F    22.1835  -25.1093
            19  C1a C    24.5637  -21.0291
            20  O1a O    25.7197  -20.3490
            21  C1a C    21.0000  -23.0300
            22  O5x O    17.4277  -26.4938
            23  C1a C    27.0200  -21.3500
            24  O5x O    20.9800  -21.6958
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21   10  18 1 #Down
            22   12  19 1 #Up
            23   17  20 1 #Up
            24    5  21 1 #Up
            25    2  22 2
            26   17  23 1 #Down
            27   14  24 2

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