COMPOUND: C14675
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Entry
C14675 Compound
Name
11beta,21-Dihydroxypregn-4-ene-3,20-dione 21-acetate;
Corticosterone 21-acetate
Formula
C23H32O5
Exact mass
388.225
Mol weight
388.4972
Structure
Mol file
KCF file
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Other DBs
CAS:
1173-26-8
PubChem:
17395674
ChEBI:
34141
NIKKAJI:
J15.036C
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KCF data
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ATOM 28
1 C1x C 21.0487 -21.3705
2 C5x C 21.0487 -22.7321
3 C2x C 22.2278 -23.4128
4 C2y C 23.4068 -22.7321
5 C1z C 23.4068 -21.3705
6 C1x C 22.2278 -20.6898
7 C1x C 24.5860 -23.4128
8 C1x C 25.7650 -22.7321
9 C1y C 25.7650 -21.3705
10 C1y C 24.5860 -20.6898
11 C1y C 26.9442 -20.6898
12 C1z C 26.9442 -19.3284
13 C1x C 25.7650 -18.6477
14 C1y C 24.5860 -19.3284
15 C1x C 29.3022 -20.6898
16 C1x C 29.3022 -19.3284
17 C1y C 28.1231 -18.6477
18 C1a C 26.9712 -17.9670
19 C5a C 28.1283 -17.2862
20 C1a C 23.4038 -19.9699
21 C1b C 29.3127 -16.6085
22 O5x O 19.8448 -23.4274
23 O5a O 26.9290 -16.5875
24 O7a O 30.5270 -17.3160
25 C7a C 31.7480 -16.6177
26 C1a C 32.9687 -17.3296
27 O6a O 31.7534 -15.1903
28 O1a O 23.3579 -18.6194
BOND 31
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
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 5 20 1 #Up
24 19 21 1
25 2 22 2
26 19 23 2
27 21 24 1
28 24 25 1
29 25 26 1
30 25 27 2
31 14 28 1 #Up
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