COMPOUND: C15294
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Entry
C15294 Compound
Name
N-Methylindolo[3,2-b]-5alpha-cholest-2-ene;
1'-Methyl-1'H-5alpha-cholest-2-eno[3,2-b]indole
Formula
C34H51N
Exact mass
473.4022
Mol weight
473.7754
Structure
Mol file
KCF file
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Other DBs
PubChem:
17396291
ChEBI:
79796
NIKKAJI:
J122.929J
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KCF data
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ATOM 35
1 C1y C 26.5059 -20.0138
2 C1y C 25.3119 -20.7129
3 C1z C 26.5119 -18.6343
4 C1x C 28.8934 -20.0262
5 C1y C 24.1244 -20.0262
6 C1x C 25.3366 -22.1233
7 C1y C 27.7057 -17.9479
8 C1x C 25.3058 -17.9539
9 C1a C 26.5386 -17.1684
10 C1x C 28.8997 -18.6467
11 C1z C 22.9429 -20.7190
12 C1x C 24.1490 -18.4489
13 C1x C 24.1367 -22.7604
14 C1c C 27.7120 -16.5994
15 C1y C 22.9429 -22.0798
16 C1x C 21.7676 -20.0449
17 C1a C 22.9323 -19.0969
18 C1b C 28.8811 -15.9312
19 C1a C 26.1883 -15.8967
20 C1x C 21.7676 -22.7665
21 C8y C 20.5985 -20.7190
22 C1b C 30.0441 -16.6118
23 C8y C 20.5985 -22.0798
24 C1b C 31.2070 -15.9436
25 C1c C 32.3698 -16.6179
26 C1a C 33.5390 -15.9498
27 C1a C 32.3698 -17.9663
28 C8y C 18.1737 -20.7190
29 C8y C 18.1737 -22.0798
30 N4y N 19.3861 -22.7798
31 C8x C 16.9612 -20.0190
32 C8x C 15.7488 -20.7190
33 C8x C 15.7488 -22.0798
34 C8x C 16.9612 -22.7798
35 C1a C 19.3862 -24.1500
BOND 40
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 3 9 1 #Up
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 7 14 1
14 11 15 1
15 11 16 1
16 11 17 1 #Up
17 14 18 1
18 14 19 1 #Down
19 15 20 1
20 16 21 1
21 18 22 1
22 20 23 1
23 22 24 1
24 24 25 1
25 25 26 1
26 25 27 1
27 7 10 1
28 8 12 1
29 13 15 1
30 21 23 2
31 21 28 1
32 28 29 2
33 29 30 1
34 23 30 1
35 28 31 1
36 31 32 2
37 32 33 1
38 33 34 2
39 29 34 1
40 30 35 1
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