 | | COMPOUND: C08587 | |
| Entry |
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| Name |
beta-Carotene 5,6-epoxide;
5,6-Epoxy-beta,beta-carotene
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| Formula |
C40H56O
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| Exact mass |
552.4331
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| Mol weight |
552.872
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| Structure |
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| Brite |
Lipids [BR:br08002]
PR Prenol lipids
PR01 Isoprenoids
PR0107 C40 isoprenoids (tetraterpenes)
C08587 beta-Carotene 5,6-epoxide
Phytochemical compounds [BR:br08003]
Terpenoids
Carotenoids and apocarotenoids
Carotenoids
C08587 beta-Carotene 5,6-epoxide
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| Other DBs |
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| KCF data |
ATOM 41
1 C1z C 15.1944 -18.0310
2 C1z C 15.1944 -19.4402
3 O2x O 16.4079 -18.7278
4 C1z C 13.9809 -17.3343
5 C2b C 16.4001 -17.3343
6 C1x C 13.9809 -20.1447
7 C1a C 16.4001 -20.1447
8 C1x C 12.7597 -18.0310
9 C1a C 14.6620 -16.0430
10 C1a C 13.4651 -16.0421
11 C2b C 17.6057 -18.0310
12 C1x C 12.7597 -19.4323
13 C2c C 18.8192 -17.3343
14 C2b C 20.0327 -18.0310
15 C1a C 18.8192 -15.9328
16 C2b C 21.2382 -17.3343
17 C2b C 22.4517 -18.0310
18 C2c C 23.6652 -17.3343
19 C2b C 24.8785 -18.0310
20 C1a C 23.6652 -15.9328
21 C2b C 26.0843 -17.3343
22 C2b C 27.2978 -18.0310
23 C2b C 28.5110 -17.3343
24 C2c C 29.7245 -18.0310
25 C2b C 30.9380 -17.3343
26 C1a C 29.7245 -19.4323
27 C2b C 32.1438 -18.0310
28 C2b C 33.3571 -17.3343
29 C2c C 34.5705 -18.0310
30 C2b C 35.7761 -17.3343
31 C1a C 34.5705 -19.4323
32 C2b C 36.9896 -18.0310
33 C2y C 38.2031 -17.3343
34 C1z C 39.4166 -18.0310
35 C2y C 38.2031 -15.9328
36 C1x C 40.6301 -17.3420
37 C1a C 40.1054 -19.2445
38 C1a C 38.7686 -19.3153
39 C1x C 39.4166 -15.2360
40 C1a C 36.9896 -15.2283
41 C1x C 40.6301 -15.9407
BOND 43
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 1
7 4 8 1
8 4 9 1
9 4 10 1
10 5 11 2
11 6 12 1
12 11 13 1
13 13 14 2
14 13 15 1
15 14 16 1
16 16 17 2
17 17 18 1
18 18 19 2
19 18 20 1
20 19 21 1
21 21 22 2
22 22 23 1
23 23 24 2
24 24 25 1
25 24 26 1
26 25 27 2
27 27 28 1
28 28 29 2
29 29 30 1
30 29 31 1
31 30 32 2
32 32 33 1
33 33 34 1
34 33 35 2
35 34 36 1
36 34 37 1
37 34 38 1
38 35 39 1
39 35 40 1
40 36 41 1
41 2 3 1
42 8 12 1
43 39 41 1
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