| Entry |
|
|---|
| Name |
|
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| Formula |
C28H46O
|
|---|
| Exact mass |
398.3549
|
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| Mol weight |
398.66
|
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| Structure |
|
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| Reaction |
|
|---|
| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Module |
| M00917 | Phytosterol biosynthesis, squalene 2,3-epoxide => campesterol/sitosterol |
|
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| Enzyme |
|
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| Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST01 Sterols
ST0103 Ergosterols and C24-methyl derivatives
C15781 24-Methylenecholesterol
|
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| Other DBs |
|
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| LinkDB |
|
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| KCF data |
ATOM 29
1 C1y C 26.4047 -21.9621
2 C1y C 25.2882 -22.6506
3 C1z C 26.4110 -20.5911
4 C1x C 28.7842 -22.0075
5 C1y C 24.0377 -21.9745
6 C1x C 25.2703 -24.1263
7 C1y C 27.5975 -19.9024
8 C1x C 25.2121 -19.9148
9 C1a C 26.3682 -19.1830
10 C1x C 28.7842 -20.5973
11 C1z C 22.8696 -22.6630
12 C1x C 24.0256 -20.6034
13 C2x C 24.0500 -24.6919
14 C1c C 27.6037 -18.5683
15 C2y C 22.8696 -24.0094
16 C1x C 21.6952 -21.9929
17 C1a C 22.8891 -21.2937
18 C1b C 28.7658 -17.9043
19 C1a C 26.4479 -17.8982
20 C1x C 21.6952 -24.6981
21 C1x C 20.5394 -22.6630
22 C1b C 29.9216 -18.5745
23 C1y C 20.5394 -24.0094
24 O1a O 19.3775 -24.6736
25 C2c C 31.1274 -17.8927
26 C1c C 32.3375 -18.5914
27 C1a C 33.5476 -17.8927
28 C1a C 32.3375 -19.9885
29 C2a C 31.1336 -16.4957
BOND 32
1 1 2 1
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 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 14 19 1 #Down
19 15 20 1
20 16 21 1
21 18 22 1
22 20 23 1
23 23 24 1 #Up
24 7 10 1
25 8 12 1
26 13 15 2
27 21 23 1
28 22 25 1
29 25 26 1
30 26 27 1
31 26 28 1
32 25 29 2
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