Entry |
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Name |
20-Hydroxy-3-oxopregn-4-en-21-al
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Formula |
C21H30O3
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Exact mass |
330.2195
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Mol weight |
330.4611
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Structure |
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Reaction |
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Enzyme |
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Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST02 Steroids
ST0203 C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives
C04108 20-Hydroxy-3-oxopregn-4-en-21-al
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Other DBs |
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LinkDB |
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KCF data |
ATOM 24
1 C1y C 30.2502 -21.0723
2 C1y C 29.0613 -21.7624
3 C1z C 30.2564 -19.6986
4 C1x C 32.5891 -21.0723
5 C1y C 27.8784 -21.0846
6 C1x C 29.0736 -23.1301
7 C1y C 31.4455 -19.0085
8 C1x C 29.0550 -19.0210
9 C1a C 30.2133 -18.2531
10 C1x C 32.6345 -19.7046
11 C1z C 26.7078 -21.7748
12 C1x C 27.8661 -19.7109
13 C1x C 27.8907 -23.8078
14 C1c C 31.4208 -17.5793
15 C2y C 26.7078 -23.1301
16 C1x C 25.5311 -21.1032
17 C1a C 26.6709 -20.4872
18 C4a C 30.2502 -16.6181
19 O1a O 32.6282 -17.0001
20 C2x C 25.5311 -23.8138
21 C1x C 24.3729 -21.7748
22 C5x C 24.3729 -23.1301
23 O5x O 23.2086 -23.7891
24 O4a O 28.9404 -17.1106
BOND 27
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
19 15 20 2
20 16 21 1
21 20 22 1
22 22 23 2
23 7 10 1
24 8 12 1
25 13 15 1
26 21 22 1
27 18 24 2
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