| Entry |
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| Name |
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| Formula |
C29H44O2
|
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| Exact mass |
424.3341
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| Mol weight |
424.6585
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| Structure |
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| Reaction |
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| Pathway |
| map00130 | Ubiquinone and other terpenoid-quinone biosynthesis |
| map01110 | Biosynthesis of secondary metabolites |
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| Module |
| M00112 | Tocopherol/tocotorienol biosynthesis, homogentisate + phytyl/geranylgeranyl-PP => tocopherol/tocotorienol |
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| Enzyme |
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| Brite |
Lipids [BR:br08002]
PR Prenol lipids
PR02 Quinones and hydroquinones
PR0202 Vitamin E
C14153 alpha-Tocotrienol
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| Other DBs |
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| KCF data |
ATOM 31
1 C8y C 21.6106 -17.8455
2 C8y C 21.6106 -16.4748
3 O2x O 22.8521 -18.5707
4 C8y C 20.4369 -18.5707
5 C1x C 22.8521 -15.7557
6 C8y C 20.4369 -15.7557
7 C1z C 24.0319 -17.8455
8 C8y C 19.1954 -17.8455
9 C1a C 20.4369 -19.9656
10 C1x C 24.0319 -16.4748
11 C8y C 19.1954 -16.4748
12 C1a C 20.4369 -14.3608
13 C1b C 25.2857 -18.5707
14 C1a C 24.0319 -19.4321
15 C1a C 17.9601 -18.5707
16 O1a O 17.9601 -15.7557
17 C1b C 26.4780 -17.9314
18 C2b C 27.7009 -18.6443
19 C2c C 28.9424 -18.0052
20 C1b C 30.1531 -18.7303
21 C1a C 28.9387 -16.6468
22 C1b C 31.3823 -18.0052
23 C2b C 32.5683 -18.7303
24 C2c C 33.8098 -18.0420
25 C1b C 35.0081 -18.7979
26 C1a C 33.8098 -16.6900
27 C1b C 36.2250 -18.1158
28 C2b C 37.4111 -18.8656
29 C2c C 38.6403 -18.1158
30 C1a C 38.6403 -16.7637
31 C1a C 39.8387 -18.8656
BOND 32
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 1
8 4 9 1
9 5 10 1
10 6 11 1
11 6 12 1
12 7 13 1 #Up
13 7 14 1 #Down
14 8 15 1
15 11 16 1
16 13 17 1
17 17 18 1
18 18 19 2
19 19 20 1
20 19 21 1
21 20 22 1
22 22 23 1
23 23 24 2
24 24 25 1
25 24 26 1
26 25 27 1
27 27 28 1
28 28 29 2
29 29 30 1
30 29 31 1
31 7 10 1
32 8 11 2
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