KEGG   COMPOUND: C15014
Entry
C15014                      Compound                               
Name
3-(2-Propenyloxy)estra-1,3,5(10)-triene-16,17-dione 16-oxime
Formula
C21H25NO3
Exact mass
339.1834
Mol weight
339.4281
Structure
Other DBs
PubChem: 17396011
ChEBI: 79537
NIKKAJI: J2.791.534E
LinkDB
KCF data

ATOM        25
            1   C1y C    31.7503  -20.5619
            2   C1y C    30.5734  -21.2379
            3   C1z C    31.7562  -19.2103
            4   C1x C    34.0864  -20.5913
            5   C1y C    29.4023  -20.5446
            6   C1x C    30.5734  -22.5956
            7   C1x C    30.5967  -18.5226
            8   C5x C    32.9392  -18.5459
            9   C1a C    31.7503  -17.8525
            10  C2y C    34.1046  -19.2392
            11  C8y C    28.2194  -21.2264
            12  C1x C    29.4142  -19.1925
            13  C1x C    29.3905  -23.2657
            14  C8y C    28.2136  -22.5839
            15  C8x C    27.0423  -20.5446
            16  C8x C    27.0423  -23.2598
            17  C8x C    25.8014  -21.2264
            18  C8y C    25.7952  -22.5839
            19  O5x O    32.9571  -17.1268
            20  N2b N    35.3412  -18.5470
            21  O2a O    24.5998  -23.2924
            22  C1b C    23.4060  -22.6213
            23  C2b C    22.2271  -23.3200
            24  C2a C    21.0096  -22.6354
            25  O1b O    36.5186  -19.2476
BOND        28
            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 2
            14   11  15 1
            15   14  16 1
            16   15  17 2
            17   16  18 2
            18    7  12 1
            19    8  10 1
            20   13  14 1
            21   17  18 1
            22    8  19 2
            23   10  20 2
            24   18  21 1
            25   21  22 1
            26   22  23 1
            27   23  24 2
            28   20  25 1

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