KEGG   COMPOUND: C14488
Entry
C14488                      Compound                               
Name
21-Fluoroprogesterone;
21-Fluoropregn-4-ene-3,20-dione
Formula
C21H29FO2
Exact mass
332.2152
Mol weight
332.4522
Structure
Other DBs
CAS: 434-18-4
PubChem: 17395488
ChEBI: 34309
NIKKAJI: J66.982B
LinkDB
KCF data

ATOM        24
            1   C1z C    20.9814  -14.8992
            2   C1y C    22.1630  -14.2240
            3   C1y C    20.9699  -16.2669
            4   C1x C    19.8115  -14.2181
            5   C1a C    20.9756  -13.5373
            6   C1x C    23.3445  -14.9109
            7   C5a C    22.1515  -12.8562
            8   C1y C    19.7883  -16.9421
            9   C1x C    23.3330  -16.2785
            10  C1x C    18.6243  -14.8876
            11  C1y C    18.6126  -16.2495
            12  C1x C    19.7883  -18.3100
            13  C1z C    17.4309  -16.9246
            14  C1x C    18.6009  -18.9853
            15  C2y C    17.4253  -18.2984
            16  C1x C    16.2552  -16.2436
            17  C2x C    16.2552  -18.9793
            18  C1x C    15.0737  -16.9246
            19  C5x C    15.0737  -18.2984
            20  O5x O    13.8863  -18.9736
            21  C1a C    17.4191  -15.5626
            22  O5a O    20.9161  -12.1567
            23  C1b C    23.3471  -12.1522
            24  X   F    24.5369  -12.8258
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     2   7 1 #Up
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    8  11 1
            11    8  12 1
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 1
            16   15  17 2
            17   16  18 1
            18   17  19 1
            19   19  20 2
            20    6   9 1
            21   10  11 1
            22   14  15 1
            23   18  19 1
            24   13  21 1 #Up
            25    7  22 2
            26    7  23 1
            27   23  24 1

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