| Entry |
|
|---|
| Name |
Testololactone;
3-Oxo-13,17-secoandrost-4-ene-17,13alpha-lactone
|
|---|
| Formula |
C19H26O3
|
|---|
| Exact mass |
302.1882
|
|---|
| Mol weight |
302.41
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
|
|---|
| Enzyme |
|
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| Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST02 Steroids
ST0202 C19 steroids (androgens) and derivatives
C04676 3-Oxo-13,17-secoandrost-4-ene-17,13alpha-lactone
|
|---|
| Other DBs |
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| LinkDB |
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|---|
| KCF data |
ATOM 22
1 C1y C 27.7506 -18.2205
2 C1z C 26.5249 -18.9266
3 C1y C 28.9527 -18.9266
4 C1x C 27.7506 -16.8199
5 C2y C 26.5249 -20.3447
6 C1x C 25.3111 -18.2205
7 C1a C 26.5249 -17.6077
8 C1y C 30.1607 -18.2437
9 C1x C 28.9527 -20.3447
10 C1x C 28.9527 -16.1546
11 C1x C 27.7506 -21.0450
12 C2x C 25.3111 -21.0450
13 C1x C 24.1031 -18.9266
14 C1z C 30.1607 -16.8724
15 C1x C 31.3747 -18.9500
16 C5x C 24.1031 -20.3447
17 O7x O 31.3630 -16.1721
18 C1a C 30.1607 -15.4310
19 C1x C 32.5827 -18.2730
20 O5x O 22.9126 -21.0509
21 C7x C 32.5827 -16.8724
22 O6a O 33.7906 -16.1721
BOND 25
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 2 7 1 #Up
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 1
11 5 12 2
12 6 13 1
13 8 14 1
14 8 15 1
15 12 16 1
16 14 17 1
17 14 18 1 #Up
18 15 19 1
19 16 20 2
20 17 21 1
21 21 22 2
22 9 11 1
23 10 14 1
24 13 16 1
25 19 21 1
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|---|
