Entry |
|
Name |
(S)-2,3-Epoxysqualene;
Squalene 2,3-epoxide;
Squalene 2,3-oxide;
(S)-Squalene-2,3-epoxide;
2,3-Oxidosqualene;
(3S)-2,3-Epoxy-2,3-dihydrosqualene
|
Formula |
C30H50O
|
Exact mass |
426.3862
|
Mol weight |
426.72
|
Structure |
|
Reaction |
|
Pathway |
map00909 | Sesquiterpenoid and triterpenoid biosynthesis |
map00996 | Biosynthesis of various alkaloids |
map00999 | Biosynthesis of various plant secondary metabolites |
map01060 | Biosynthesis of plant secondary metabolites |
map01062 | Biosynthesis of terpenoids and steroids |
map01110 | Biosynthesis of secondary metabolites |
|
Module |
M00101 | Cholesterol biosynthesis, FPP => cholesterol |
M00102 | Ergocalciferol biosynthesis, FPP => ergosterol/ergocalciferol |
M00917 | Phytosterol biosynthesis, squalene 2,3-epoxide => campesterol/sitosterol |
M00971 | QS-7 biosynthesis, 2,3-epoxysqualene => QS-7 |
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Enzyme |
|
Brite |
Lipids [BR:br08002]
PR Prenol lipids
PR01 Isoprenoids
PR0106 C30 isoprenoids (triterpenes)
PR010601 Acyclic triterpenoids
C01054 (S)-2,3-Epoxysqualene
Phytochemical compounds [BR:br08003]
Terpenoids
Triterpenoids (C30)
Liner triterpenes
C01054 (S)-2,3-Epoxysqualene
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Other DBs |
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LinkDB |
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KCF data |
ATOM 31
1 C2c C 17.4647 -21.7471
2 C2b C 18.6797 -21.0456
3 C1b C 19.8948 -21.7471
4 C1b C 21.1100 -21.0456
5 C2c C 22.3250 -21.7471
6 C2b C 23.5401 -21.0456
7 C1b C 24.7551 -21.7471
8 C1b C 25.9701 -21.0456
9 C2b C 27.1853 -21.7471
10 C2c C 28.4003 -21.0456
11 C1b C 29.6154 -21.7471
12 C1b C 30.8304 -21.0456
13 C2b C 32.0454 -21.7471
14 C2c C 33.2605 -21.0456
15 C1b C 34.4756 -21.7471
16 C1b C 35.6907 -21.0456
17 C2b C 36.9058 -21.7471
18 C2c C 38.1208 -21.0456
19 C1a C 39.3121 -21.7337
20 C1a C 38.1209 -19.6430
21 C1a C 33.2605 -19.6426
22 C1a C 28.4003 -19.6426
23 C1a C 22.3250 -23.1500
24 C1b C 16.2497 -21.0456
25 C1a C 17.4647 -23.1501
26 C1b C 15.0516 -21.7375
27 C1y C 13.8616 -21.0505
28 C1z C 12.4586 -21.0505
29 O2x O 13.1601 -19.8355
30 C1a C 11.4666 -22.0426
31 C1a C 11.3594 -20.2068
BOND 31
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 2
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 2
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 2
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 2
18 18 19 1
19 18 20 1
20 14 21 1
21 10 22 1
22 5 23 1
23 1 24 1
24 1 25 1
25 24 26 1
26 26 27 1
27 27 28 1
28 27 29 1 #Up
29 28 29 1
30 28 30 1
31 28 31 1
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