KEGG   COMPOUND: C15400
Entry
C15400                      Compound                               
Name
9-Chloro-11beta,17beta-dihydroxy-17-methylandrost-4-en-3-one;
9-Chloro-11beta-hydroxy-17-methyltestosterone
Formula
C20H29ClO3
Exact mass
352.1805
Mol weight
352.8955
Structure
Other DBs
PubChem: 17396397
ChEBI: 79901
NIKKAJI: J2.794.341A
LinkDB
KCF data

ATOM        24
            1   C1y C    27.0475  -19.7828
            2   C1z C    25.8817  -19.1148
            3   C1y C    28.2197  -19.1026
            4   C1x C    27.0291  -21.1795
            5   C1z C    24.7218  -19.7950
            6   C1y C    25.8695  -17.7605
            7   C1z C    28.2256  -17.7484
            8   C1x C    30.5637  -19.1086
            9   C1x C    25.8877  -21.7989
            10  C2y C    24.7218  -21.1309
            11  C1x C    23.5801  -19.1391
            12  C1a C    24.7036  -18.1673
            13  C1x C    27.0415  -17.0804
            14  C1z C    29.3977  -17.0744
            15  C1a C    28.2255  -16.1363
            16  C1x C    30.5637  -17.7605
            17  C2x C    23.5618  -21.8050
            18  C1x C    22.4203  -19.7950
            19  C5x C    22.4203  -21.1309
            20  X   Cl   25.8755  -20.4324
            21  O5x O    21.1852  -21.8359
            22  O1a O    24.6845  -17.0852
            23  O1a O    29.4047  -15.6800
            24  C1a C    30.7500  -16.7121
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    5  12 1 #Up
            12    6  13 1
            13    7  14 1
            14    7  15 1 #Up
            15    8  16 1
            16   10  17 2
            17   11  18 1
            18   17  19 1
            19    7  13 1
            20    9  10 1
            21   14  16 1
            22   18  19 1
            23    2  20 1 #Down
            24   19  21 2
            25    6  22 1 #Up
            26   14  23 1 #Up
            27   14  24 1 #Down

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