COMPOUND: C15124
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Entry
C15124 Compound
Name
3-Methoxy-D-homoestra-1,3,5(10),8-tetraen-17a-one
Formula
C20H24O2
Exact mass
296.1776
Mol weight
296.4034
Structure
Mol file
KCF file
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Other DBs
PubChem:
17396121
ChEBI:
79642
NIKKAJI:
J2.793.054I
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KCF data
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ATOM 22
1 C1y C 31.8575 -20.5781
2 C2y C 30.6506 -21.2713
3 C1z C 31.8636 -19.1921
4 C1x C 34.3230 -20.6083
5 C2y C 29.4497 -20.5603
6 C1x C 30.6506 -22.6635
7 C1x C 30.6745 -18.4868
8 C5x C 33.0766 -18.5108
9 C1a C 31.8575 -17.7998
10 C1x C 34.2717 -19.2217
11 C8y C 28.2367 -21.2595
12 C1x C 29.4599 -19.1738
13 C1x C 29.4375 -23.3508
14 C8y C 28.2307 -22.6516
15 C8x C 27.0296 -20.5603
16 C8x C 27.0296 -23.3448
17 C8x C 25.7572 -21.2595
18 C8y C 25.7508 -22.6516
19 C1x C 33.0283 -21.2934
20 O5x O 33.0929 -17.0556
21 O2a O 24.5249 -23.3782
22 C1a C 23.3007 -22.6899
BOND 25
1 1 2 1
2 1 3 1
3 2 5 2
4 2 6 1
5 3 7 1
6 3 8 1
7 3 9 1 #Up
8 4 10 1
9 5 11 1
10 5 12 1
11 6 13 1
12 11 14 2
13 11 15 1
14 14 16 1
15 15 17 2
16 16 18 2
17 7 12 1
18 8 10 1
19 13 14 1
20 17 18 1
21 4 19 1
22 19 1 1
23 8 20 2
24 18 21 1
25 21 22 1
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