COMPOUND: C14684
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Entry
C14684 Compound
Name
17beta-Hydroxy-17-methylandrosta-4,9(11)-dien-3-one;
4,9(11)-Androstadien-17alpha-methyl-17beta-ol-3-one
Formula
C20H28O2
Exact mass
300.2089
Mol weight
300.4351
Structure
Mol file
KCF file
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Other DBs
CAS:
1039-17-4
PubChem:
17395683
ChEBI:
34182
NIKKAJI:
J208.705G
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KCF data
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ATOM 22
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 C2y 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 C2x C 24.5860 -19.3284
15 C1x C 29.3022 -20.6898
16 C1x C 29.3022 -19.3284
17 C1z C 28.1231 -18.6477
18 C1a C 26.9712 -17.9670
19 O1a O 28.1283 -17.2862
20 C1a C 23.4038 -19.9699
21 C1a C 29.4700 -18.2700
22 O5x O 19.8448 -23.4274
BOND 25
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 2
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 17 21 1 #Down
25 2 22 2
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