COMPOUND: C15029
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Entry
C15029 Compound
Name
3,6-Dimethoxy-19-norpregna-1,3,5,7,9-pentaen-20-one
Formula
C22H26O3
Exact mass
338.1882
Mol weight
338.44
Structure
Mol file
KCF file
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Other DBs
PubChem:
17396026
ChEBI:
79551
NIKKAJI:
J2.791.707K
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KCF data
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ATOM 25
1 C8y C 22.3470 -17.5806
2 C8y C 21.2283 -16.9454
3 C1y C 23.4543 -16.9337
4 C8x C 22.3237 -18.8509
5 C8y C 20.1328 -17.5923
6 C1x C 21.2224 -15.6634
7 C1z C 23.4543 -15.6518
8 C1x C 25.6804 -16.9396
9 C8y C 21.3100 -19.4919
10 C8y C 20.1328 -18.8626
11 C8x C 19.0315 -16.9630
12 C1x C 22.3354 -15.0167
13 C1y C 24.5789 -15.0108
14 C1x C 25.6861 -15.6577
15 C8x C 19.0315 -19.5036
16 C8x C 17.9476 -17.5923
17 C5a C 24.5789 -13.7521
18 C8y C 17.9476 -18.8626
19 C1a C 25.6687 -13.1345
20 C1a C 23.4543 -14.2518
21 O5a O 23.3486 -13.0357
22 O2a O 16.7254 -19.5600
23 C1a C 15.5070 -18.8486
24 O2a O 21.2512 -20.8594
25 C1a C 20.0658 -21.5569
BOND 28
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 1
12 7 13 1
13 8 14 1
14 10 15 1
15 11 16 2
16 13 17 1 #Up
17 15 18 2
18 17 19 1
19 7 12 1
20 9 10 2
21 13 14 1
22 16 18 1
23 7 20 1 #Up
24 17 21 2
25 18 22 1
26 22 23 1
27 9 24 1
28 24 25 1
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