| Entry |
|
|---|
| Name |
20alpha-Hydroxycholesterol;
20-Hydroxycholesterol
|
|---|
| Formula |
C27H46O2
|
|---|
| Exact mass |
402.3498
|
|---|
| Mol weight |
402.65
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
|
|---|
| Module |
| M00107 | Steroid hormone biosynthesis, cholesterol => pregnenolone => progesterone |
|
|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST01 Sterols
ST0101 Cholesterol and derivatives
C05500 20alpha-Hydroxycholesterol
|
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| Other DBs |
|
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| LinkDB |
|
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| KCF data |
ATOM 29
1 C1x C 32.0691 -26.2326
2 C1y C 32.0691 -27.6068
3 C1x C 33.2592 -28.2939
4 C2y C 34.4494 -27.6068
5 C1z C 34.4494 -26.2326
6 C1x C 33.2592 -25.5455
7 C2x C 35.6395 -28.2939
8 C1x C 36.8296 -27.6068
9 C1y C 36.8296 -26.2326
10 C1y C 35.6395 -25.5455
11 C1y C 38.0198 -25.5455
12 C1z C 38.0198 -24.1712
13 C1x C 36.8296 -23.4841
14 C1x C 35.6395 -24.1712
15 C1x C 40.3999 -25.5455
16 C1x C 40.3999 -24.1712
17 C1y C 39.2098 -23.4841
18 C1a C 38.0198 -22.7970
19 C1a C 34.4494 -24.8583
20 O1a O 30.8790 -28.2939
21 C1d C 40.3999 -22.7970
22 O1a O 41.5775 -23.4769
23 C1b C 40.3999 -21.4228
24 C1a C 41.5775 -22.1170
25 C1b C 41.5776 -20.7429
26 C1b C 41.5777 -19.3617
27 C1c C 42.7481 -18.6858
28 C1a C 43.9117 -19.3576
29 C1a C 42.7483 -17.3003
BOND 32
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 2
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 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 12 18 1 #Up
22 5 19 1 #Up
23 2 20 1 #Up
24 17 21 1
25 21 22 1
26 21 23 1
27 21 24 1 #Up
28 23 25 1
29 25 26 1
30 26 27 1
31 27 28 1
32 27 29 1
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