Entry
Name
7alpha,26-Dihydroxy-4-cholesten-3-one
Formula
C27H44O3
Exact mass
416.329
Mol weight
416.6365
Structure
Mol file KCF file DB search
Reaction
Pathway
Enzyme
Brite
Lipids [BR:br08002 ]
ST Sterol lipids
ST04 Bile acids and derivatives
ST0403 C27 bile acids, alcohols, and derivatives
C17336 7alpha,26-Dihydroxy-4-cholesten-3-one
BRITE hierarchy
Other DBs
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All DBs
KCF data
Show ATOM 30
1 C5x C 22.7775 -25.7698
2 C2x C 23.8223 -26.4664
3 C2y C 25.0761 -25.7698
4 C1z C 25.0761 -24.3768
5 C1x C 23.8223 -23.6802
6 C1x C 22.7775 -24.3768
7 C1x C 26.2602 -26.4664
8 C1y C 27.4443 -25.7698
9 C1y C 27.4443 -24.3768
10 C1y C 26.2602 -23.6802
11 C1y C 28.6284 -23.6802
12 C1z C 28.6284 -22.3568
13 C1x C 27.4443 -21.7299
14 C1x C 26.2602 -22.3568
15 C1x C 30.9966 -23.6802
16 C1x C 30.9966 -22.3568
17 C1y C 29.8125 -21.7299
18 C1a C 28.6981 -20.8244
19 C1c C 29.8125 -20.3368
20 C1b C 30.9966 -19.6403
21 C1a C 25.0761 -23.0533
22 C1b C 32.1808 -20.3368
23 C1b C 33.3649 -19.6403
24 C1c C 34.5490 -20.3368
25 C1a C 28.8374 -19.3617
26 C1b C 35.7331 -19.6403
27 C1a C 34.5490 -21.7299
28 O1a O 28.6284 -26.4664
29 O5x O 21.5493 -26.4272
30 O1a O 36.9452 -20.3270
BOND 33
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 3 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 4 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 12 18 1 #Up
22 17 19 1
23 19 20 1
24 4 21 1 #Up
25 20 22 1
26 22 23 1
27 23 24 1
28 19 25 1 #Down
29 24 26 1
30 24 27 1
31 8 28 1 #Down
32 1 29 2
33 26 30 1