| Entry |
|
|---|
| Name |
3beta-Hydroxy-4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-4alpha-carboxylate
|
|---|
| Formula |
C31H50O3
|
|---|
| Exact mass |
470.376
|
|---|
| Mol weight |
470.7269
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00917 | Phytosterol biosynthesis, squalene 2,3-epoxide => campesterol/sitosterol |
|
|---|
| Enzyme |
|
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| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 34
1 C1z C 16.2910 -16.5695
2 C1z C 15.0379 -17.2657
3 C1y C 17.4049 -17.2657
4 C1x C 14.9683 -15.8733
5 C1x C 16.2910 -15.1075
6 C1y C 15.0379 -18.6580
7 C1x C 13.8544 -16.5695
8 C1z C 18.6580 -16.5695
9 C1x C 17.4049 -18.6580
10 C1x C 17.4745 -14.4809
11 C1z C 13.8544 -19.3542
12 C1x C 16.2214 -19.3542
13 C1x C 12.6709 -17.2657
14 C1z C 18.7277 -15.1771
15 C1x C 21.0250 -16.5695
16 C1a C 18.6580 -17.9619
17 C1y C 12.6709 -18.6580
18 C1y C 19.9112 -14.4809
19 C1a C 18.7277 -13.7848
20 C1x C 21.0250 -15.1771
21 O1a O 11.4874 -19.3542
22 C1c C 19.9112 -13.0886
23 C1b C 21.0250 -12.4620
24 C1a C 18.7277 -12.4620
25 C1b C 22.2086 -13.0886
26 C2c C 23.3921 -12.4620
27 C1c C 24.5756 -13.0886
28 C2a C 23.3921 -11.0697
29 C1a C 24.5756 -14.4809
30 C1a C 25.7591 -12.3924
31 C1a C 13.1582 -20.5377
32 C6a C 14.1329 -20.8162
33 O6a O 15.2467 -21.3035
34 O6a O 13.0604 -21.7262
BOND 38
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 5 10 1
10 6 11 1
11 6 12 1
12 7 13 1
13 8 14 1
14 8 15 1
15 8 16 1 #Down
16 11 17 1
17 14 18 1
18 14 19 1 #Up
19 15 20 1
20 17 21 1 #Up
21 18 22 1
22 22 23 1
23 22 24 1 #Down
24 23 25 1
25 25 26 1
26 26 27 1
27 26 28 2
28 27 29 1
29 27 30 1
30 2 4 1 #Up
31 9 12 1
32 10 14 1
33 13 17 1
34 18 20 1
35 11 31 1 #Up
36 11 32 1 #Down
37 32 33 2
38 32 34 1
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|---|
