| Entry |
|
|---|
| Name |
4alpha-Methylzymosterol-4-carboxylate;
4alpha-Carboxy-4beta-methyl-5alpha-cholesta-8,24-dien-3beta-ol
|
|---|
| Formula |
C29H46O3
|
|---|
| Exact mass |
442.3447
|
|---|
| Mol weight |
442.6737
|
|---|
| 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
C15808 4alpha-Methylzymosterol-4-carboxylate
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 32
1 C2y C 25.3025 -20.8974
2 C2y C 24.1040 -20.2045
3 C1y C 26.5072 -20.1920
4 C1x C 25.2450 -22.2830
5 C1z C 22.9118 -20.9036
6 C1x C 24.0915 -18.8189
7 C1z C 26.5136 -18.8064
8 C1x C 28.9168 -20.1345
9 C1x C 24.1104 -22.9697
10 C1y C 22.9118 -22.2767
11 C1x C 21.7256 -20.2234
12 C1a C 22.9056 -19.6054
13 C1x C 25.2964 -18.1134
14 C1y C 27.7182 -18.1072
15 C1a C 26.5072 -17.4456
16 C1x C 28.9168 -18.8125
17 C1z C 21.7256 -22.9697
18 C1x C 20.5461 -20.9036
19 C1c C 27.7244 -16.7527
20 C1y C 20.5461 -22.2767
21 C1b C 28.8980 -16.0785
22 C1a C 26.5510 -16.0660
23 O1a O 19.3664 -22.8810
24 C1b C 30.0715 -16.7590
25 C2b C 31.2512 -16.0847
26 C2c C 32.4247 -16.7652
27 C1a C 33.6044 -16.0910
28 C1a C 32.4184 -18.1259
29 C1a C 20.5139 -23.8093
30 C6a C 21.7256 -24.3690
31 O6a O 20.5139 -25.0686
32 O6a O 22.9375 -25.0686
BOND 35
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 #Up
33 17 30 1
34 30 31 1
35 30 32 2
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