| Entry |
|
|---|
| Name |
Typhasterol;
2-Deoxycastasterone;
(3alpha,5alpha,22R,23R,24S)-3,22,23-Trihydroxyergostan-6-one
|
|---|
| Formula |
C28H48O4
|
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| Exact mass |
448.3553
|
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| Mol weight |
448.6783
|
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| Structure |
|
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| Reaction |
|
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| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Enzyme |
|
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| Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST01 Sterols
ST0103 Ergosterols and C24-methyl derivatives
C15793 Typhasterol
Phytochemical compounds [BR:br08003]
Terpenoids
Steroids
Ergostane
C15793 Typhasterol
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 32
1 C1x C 25.8689 -22.9190
2 C1y C 25.8689 -24.2906
3 C1x C 27.0568 -24.9761
4 C1y C 28.2447 -24.2906
5 C1z C 28.2447 -22.9190
6 C1x C 27.0568 -22.2333
7 C5x C 29.4322 -24.9761
8 C1x C 30.6198 -24.2906
9 C1y C 30.6198 -22.9190
10 C1y C 29.4322 -22.2333
11 C1y C 31.8078 -22.2333
12 C1z C 31.8078 -20.8618
13 C1x C 30.6198 -20.1758
14 C1x C 29.4322 -20.8618
15 C1x C 34.1833 -22.2333
16 C1x C 34.1833 -20.8618
17 C1y C 32.9955 -20.1758
18 C1c C 32.9955 -18.8047
19 C1c C 34.1872 -18.1168
20 C1c C 35.3601 -18.7942
21 C1c C 36.5223 -18.1232
22 C1c C 37.6899 -18.7976
23 C1a C 37.6899 -20.1755
24 C1a C 28.2447 -21.5474
25 C1a C 31.8078 -19.4907
26 C1a C 31.8078 -18.1190
27 C1a C 38.8775 -18.1117
28 O5x O 29.4326 -26.3965
29 O1a O 34.1874 -16.7071
30 O1a O 35.3605 -20.2203
31 O1a O 24.6801 -24.9772
32 C1a C 36.5223 -16.7232
BOND 35
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 15 16 1
18 16 17 1
19 12 17 1
20 11 15 1
21 17 18 1
22 18 19 1
23 19 20 1
24 20 21 1
25 21 22 1
26 22 23 1
27 5 24 1 #Up
28 12 25 1 #Up
29 18 26 1 #Down
30 22 27 1
31 7 28 2
32 19 29 1 #Up
33 20 30 1 #Up
34 2 31 1 #Down
35 21 32 1 #Up
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