KEGG   COMPOUND: C14269
Entry
C14269                      Compound                               
Name
5alpha-Androstane-3,11,17-trione
Formula
C19H26O3
Exact mass
302.1882
Mol weight
302.4079
Structure
Other DBs
CAS: 1482-70-8
PubChem: 17395269
ChEBI: 34463
NIKKAJI: J112.537K
LinkDB
KCF data

ATOM        22
            1   C1y C    30.2523  -19.5656
            2   C1y C    29.1029  -20.2257
            3   C1z C    30.2578  -18.2457
            4   C1x C    32.6019  -19.5937
            5   C1y C    27.9593  -19.5485
            6   C1x C    29.1029  -21.5512
            7   C1x C    29.1258  -17.5742
            8   C5x C    31.4127  -17.5969
            9   C1a C    30.2523  -16.7837
            10  C1x C    32.6206  -18.2739
            11  C1z C    26.8043  -20.2143
            12  C5x C    27.9007  -18.2285
            13  C1x C    27.9479  -22.2055
            14  C1y C    26.7987  -21.5397
            15  C1x C    25.6552  -19.5485
            16  C1x C    25.6552  -22.1997
            17  C1x C    24.4435  -20.2143
            18  C5x C    24.4359  -21.5397
            19  O5x O    23.3508  -22.1997
            20  C1a C    26.7723  -18.7953
            21  O5x O    26.7273  -17.4968
            22  O5x O    31.4126  -16.1643
BOND        25
            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     3   9 1 #Up
            9     4  10 1
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13   11  14 1
            14   11  15 1
            15   14  16 1
            16   15  17 1
            17   16  18 1
            18   18  19 2
            19    7  12 1
            20    8  10 1
            21   13  14 1
            22   17  18 1
            23   11  20 1 #Up
            24   12  21 2
            25    8  22 2

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