COMPOUND: C14618
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Entry
C14618 Compound
Name
6alpha-Fluoroprednisolone;
Fluprednisolone;
6alpha-Fluoro-11beta,17alpha,21-trihydroxypregna-1,4-diene-3,20-dione
Formula
C21H27FO5
Exact mass
378.1843
Mol weight
378.4345
Structure
Mol file
KCF file
DB search
Remark
Same as:
D04227
Brite
Target-based classification of drugs [BR:
br08310
]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C1 (GR)
D04227 Fluprednisolone (USAN/INN)
BRITE hierarchy
Other DBs
CAS:
53-34-9
PubChem:
17395618
ChEBI:
34474
NIKKAJI:
J4.143B
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KCF data
Show
ATOM 27
1 C2x C 16.6673 -19.6648
2 C5x C 16.6673 -21.0287
3 C2x C 17.8484 -21.7105
4 C2y C 19.0294 -21.0287
5 C1z C 19.0294 -19.6648
6 C2x C 17.8484 -18.9830
7 C1y C 20.2105 -21.7105
8 C1x C 21.3915 -21.0287
9 C1y C 21.3915 -19.6648
10 C1y C 20.2105 -18.9830
11 C1y C 22.5726 -18.9830
12 C1z C 22.5726 -17.6192
13 C1x C 21.3915 -16.9374
14 C1y C 20.2105 -17.6192
15 C1x C 24.9346 -18.9830
16 C1x C 24.9346 -17.6192
17 C1z C 23.7536 -16.9374
18 C1a C 22.4597 -16.2556
19 C5a C 23.7588 -15.5737
20 X F 20.2196 -23.1048
21 O5x O 15.4445 -21.7350
22 C1b C 24.9457 -14.8945
23 O5a O 22.5333 -14.8593
24 O1a O 19.0264 -16.9283
25 O1a O 25.0626 -16.5774
26 O1a O 26.1403 -15.5906
27 C1a C 19.0264 -18.2619
BOND 30
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 12 18 1 #Up
22 17 19 1 #Up
23 7 20 1 #Down
24 2 21 2
25 19 22 1
26 19 23 2
27 14 24 1 #Up
28 17 25 1 #Down
29 22 26 1
30 5 27 1 #Up
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