| Entry |
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| Name |
16-Glucuronide-estriol;
16alpha,17beta-Estriol 16-(beta-D-glucuronide)
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| Formula |
C24H32O9
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| Exact mass |
464.2046
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| Mol weight |
464.50
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| Structure |
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| Reaction |
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| Pathway |
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| Enzyme |
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| Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST02 Steroids
ST0201 C18 steroids (estrogens) and derivatives
C05504 16alpha,17beta-Estriol 16-(beta-D-glucuronide)
ST05 Steroid conjugates
ST0501 Glucuronides
C05504 16alpha,17beta-Estriol 16-(beta-D-glucuronide)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 33
1 C1y C 25.3048 -20.9322
2 C1y C 24.0990 -21.6372
3 C1z C 25.3048 -19.5341
4 C1x C 27.7165 -20.9381
5 C1y C 22.8933 -20.9439
6 C1x C 24.1049 -23.0293
7 C1y C 26.5223 -18.8351
8 C1x C 24.0932 -18.8467
9 C1a C 25.2001 -18.1186
10 C1y C 27.7224 -19.5400
11 C8y C 21.6991 -21.6429
12 C1x C 22.9049 -19.4817
13 C1x C 22.8990 -23.7167
14 O1a O 26.5223 -17.4779
15 O2a O 28.9107 -18.8700
16 C8y C 21.6991 -23.0236
17 C8x C 20.4990 -20.9731
18 C1y C 30.0874 -19.5400
19 C8x C 20.4990 -23.7226
20 C8x C 19.3224 -21.6429
21 O2x O 31.2700 -18.8759
22 C1y C 30.0815 -20.8972
23 C8y C 19.3224 -23.0236
24 C1y C 32.4409 -19.5517
25 C1y C 31.2524 -21.5846
26 O1a O 28.8990 -21.5730
27 O1a O 18.1339 -23.6993
28 C1y C 32.4292 -20.9089
29 C6a C 33.6175 -18.8876
30 O1a O 31.2467 -22.9361
31 O1a O 33.6001 -21.5963
32 O6a O 34.7826 -19.5633
33 O6a O 33.6058 -17.5302
BOND 37
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 #Up
14 10 15 1 #Down
15 11 16 2
16 11 17 1
17 18 15 1 #Down
18 16 19 1
19 17 20 2
20 18 21 1
21 18 22 1
22 19 23 2
23 21 24 1
24 22 25 1
25 22 26 1 #Up
26 23 27 1
27 24 28 1
28 24 29 1 #Down
29 25 30 1 #Down
30 28 31 1 #Up
31 29 32 1
32 29 33 2
33 7 10 1
34 8 12 1
35 13 16 1
36 20 23 1
37 25 28 1
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