COMPOUND: C15091
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Entry
C15091 Compound
Name
9-Fluoro-17beta-hydroxy-6alpha,17-dimethylandrost-4-ene-3,11-dione
Formula
C21H29FO3
Exact mass
348.2101
Mol weight
348.4516
Structure
Mol file
KCF file
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Other DBs
PubChem:
17396088
ChEBI:
79610
NIKKAJI:
J2.792.536G
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KCF data
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ATOM 25
1 C1y C 23.3883 -17.1090
2 C1z C 22.2235 -16.4415
3 C1y C 24.5596 -16.4294
4 C1x C 23.3698 -18.5045
5 C1z C 21.0645 -17.1212
6 C5x C 22.2113 -15.0884
7 C1z C 24.5655 -15.0763
8 C1x C 26.9018 -16.4353
9 C1y C 22.2295 -19.1235
10 C2y C 21.0645 -18.4560
11 C1x C 19.9237 -16.4658
12 C1a C 21.0463 -15.4948
13 C1x C 23.3823 -14.4088
14 C1z C 25.7366 -14.4028
15 C1a C 24.5654 -13.4654
16 C1x C 26.9018 -15.0884
17 C2x C 19.9054 -19.1296
18 C1x C 18.7649 -17.1212
19 C5x C 18.7649 -18.4560
20 X F 22.2173 -17.7581
21 O5x O 17.5307 -19.1605
22 O5x O 21.0274 -14.4136
23 O1a O 25.7437 -13.0095
24 C1a C 22.2139 -20.4932
25 C1a C 27.0879 -14.0406
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 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 2
26 14 23 1 #Up
27 9 24 1 #Down
28 14 25 1 #Down
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