Entry |
|
Name |
Episterone;
5alpha-Ergosta-7,24(28)-dien-3-one
|
Formula |
C28H44O
|
Exact mass |
396.3392
|
Mol weight |
396.65
|
Structure |
|
Reaction |
|
Pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Module |
M00917 | Phytosterol biosynthesis, squalene 2,3-epoxide => campesterol/sitosterol |
|
Enzyme |
|
Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST01 Sterols
ST0103 Ergosterols and C24-methyl derivatives
C22122 Episterone
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 29
1 C1y C 18.6337 -17.3027
2 C2y C 17.4428 -17.9332
3 C1z C 18.6337 -15.9017
4 C1x C 21.0154 -17.3027
5 C1y C 16.2519 -17.3027
6 C2x C 17.4428 -19.4743
7 C1y C 19.8245 -15.2011
8 C1x C 17.4428 -15.2011
9 C1a C 18.6337 -14.4306
10 C1x C 21.0154 -15.9017
11 C1z C 15.0610 -18.0032
12 C1x C 16.2519 -15.9017
13 C1x C 16.2519 -20.0347
14 C1c C 19.8245 -13.8001
15 C1y C 15.0610 -19.3342
16 C1x C 13.8702 -17.3027
17 C1a C 15.0610 -16.6022
18 C1b C 21.0154 -13.1697
19 C1x C 13.8702 -20.0347
20 C1x C 12.6793 -18.0032
21 C1b C 22.2063 -13.8702
22 C5x C 12.6793 -19.3342
23 O5x O 11.4884 -20.0347
24 C2c C 23.3972 -13.1697
25 C1c C 24.5880 -13.8702
26 C1a C 25.8490 -13.1697
27 C1a C 24.5880 -15.2712
28 C2a C 23.3972 -11.7686
29 C1a C 18.6120 -13.1001
BOND 32
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 3 9 1 #Up
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 7 14 1
14 11 15 1
15 11 16 1
16 11 17 1 #Up
17 14 18 1
18 15 19 1
19 16 20 1
20 18 21 1
21 19 22 1
22 22 23 2 #Up
23 7 10 1
24 8 12 1
25 13 15 1
26 20 22 1
27 21 24 1
28 24 25 1
29 25 26 1
30 25 27 1
31 24 28 2
32 14 29 1 #Down
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