COMPOUND: C14488
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Entry
C14488 Compound
Name
21-Fluoroprogesterone;
21-Fluoropregn-4-ene-3,20-dione
Formula
C21H29FO2
Exact mass
332.2152
Mol weight
332.4522
Structure
Mol file
KCF file
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Other DBs
CAS:
434-18-4
PubChem:
17395488
ChEBI:
34309
NIKKAJI:
J66.982B
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KCF data
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ATOM 24
1 C1z C 20.9814 -14.8992
2 C1y C 22.1630 -14.2240
3 C1y C 20.9699 -16.2669
4 C1x C 19.8115 -14.2181
5 C1a C 20.9756 -13.5373
6 C1x C 23.3445 -14.9109
7 C5a C 22.1515 -12.8562
8 C1y C 19.7883 -16.9421
9 C1x C 23.3330 -16.2785
10 C1x C 18.6243 -14.8876
11 C1y C 18.6126 -16.2495
12 C1x C 19.7883 -18.3100
13 C1z C 17.4309 -16.9246
14 C1x C 18.6009 -18.9853
15 C2y C 17.4253 -18.2984
16 C1x C 16.2552 -16.2436
17 C2x C 16.2552 -18.9793
18 C1x C 15.0737 -16.9246
19 C5x C 15.0737 -18.2984
20 O5x O 13.8863 -18.9736
21 C1a C 17.4191 -15.5626
22 O5a O 20.9161 -12.1567
23 C1b C 23.3471 -12.1522
24 X F 24.5369 -12.8258
BOND 27
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1 #Up
7 3 8 1
8 3 9 1
9 4 10 1
10 8 11 1
11 8 12 1
12 11 13 1
13 12 14 1
14 13 15 1
15 13 16 1
16 15 17 2
17 16 18 1
18 17 19 1
19 19 20 2
20 6 9 1
21 10 11 1
22 14 15 1
23 18 19 1
24 13 21 1 #Up
25 7 22 2
26 7 23 1
27 23 24 1
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