| Entry |
|
|---|
| Name |
4alpha-Carboxy-5alpha-cholesta-8,24-dien-3beta-ol
|
|---|
| Formula |
C28H44O3
|
|---|
| Exact mass |
428.329
|
|---|
| Mol weight |
428.6472
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00101 | Cholesterol biosynthesis, FPP => cholesterol |
| M00102 | Ergocalciferol biosynthesis, FPP => ergosterol/ergocalciferol |
|
|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST01 Sterols
ST0101 Cholesterol and derivatives
C22112 4alpha-Carboxy-5alpha-cholesta-8,24-dien-3beta-ol
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 31
1 C2y C 17.4696 -16.4130
2 C2y C 16.2721 -15.7791
3 C1y C 18.6671 -15.7791
4 C1x C 17.4696 -17.7514
5 C1z C 15.0747 -16.4130
6 C1x C 16.2721 -14.3703
7 C1z C 18.6671 -14.3703
8 C1x C 21.0621 -15.7791
9 C1x C 16.3426 -18.4558
10 C1y C 15.0747 -17.7514
11 C1x C 13.8772 -15.7791
12 C1a C 15.0747 -15.1451
13 C1x C 17.4696 -13.6659
14 C1y C 19.8646 -13.6659
15 C1a C 18.6671 -12.9615
16 C1x C 21.0621 -14.3703
17 C1y C 13.8772 -18.4558
18 C1x C 12.7501 -16.4130
19 C1c C 19.8646 -12.2571
20 C1y C 12.7501 -17.7514
21 C1b C 21.0621 -11.6231
22 C1a C 18.6671 -11.6231
23 O1a O 11.5526 -18.4558
24 C1b C 22.2596 -12.3275
25 C2b C 23.4571 -11.6231
26 C2c C 24.5841 -12.3275
27 C1a C 25.7816 -11.6231
28 C1a C 24.5841 -13.6659
29 C6a C 13.8772 -19.8646
30 O6a O 15.0747 -20.5690
31 O6a O 12.6797 -20.7803
BOND 34
1 1 2 2
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 4 9 1
9 5 10 1
10 5 11 1
11 5 12 1 #Up
12 6 13 1
13 7 14 1
14 7 15 1 #Up
15 8 16 1
16 10 17 1
17 11 18 1
18 14 19 1
19 17 20 1
20 19 21 1
21 19 22 1 #Down
22 20 23 1 #Up
23 21 24 1
24 24 25 1
25 25 26 2
26 26 27 1
27 26 28 1
28 7 13 1
29 9 10 1
30 14 16 1
31 18 20 1
32 17 29 1 #Down
33 29 30 2
34 29 31 1
|
|---|
