| Entry |
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| Name |
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| Formula |
C21H14O8
|
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| Exact mass |
394.0689
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| Mol weight |
394.3311
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| Structure |
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| Reaction |
|
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| Pathway |
| map01057 | Biosynthesis of type II polyketide products |
| map01110 | Biosynthesis of secondary metabolites |
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| Module |
| M00783 | Tetracenomycin C/8-demethyltetracenomycin C biosynthesis, tetracenomycin F2 => tetracenomycin C/8-demethyltetracenomycin C |
|
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| Enzyme |
2.1.1.-
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1312 Other aromatic polyketides
C12369 Tetracenomycin B3
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| Other DBs |
|
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| KCF data |
ATOM 29
1 C8x C 26.3560 -15.8334
2 C8y C 20.4452 -16.5153
3 C8x C 21.6339 -15.8307
4 C8y C 22.8127 -16.5153
5 C5x C 24.0014 -15.8403
6 C8y C 25.1803 -16.5153
7 C8x C 20.4411 -18.0048
8 C8y C 27.5386 -16.5249
9 C8x C 28.7270 -15.8403
10 C8y C 29.9061 -16.5249
11 C8y C 21.6243 -18.6988
12 C8y C 22.8034 -18.0142
13 C5x C 23.9919 -18.7084
14 C8y C 25.1710 -18.0238
15 C8y C 26.3499 -18.7180
16 C8y C 27.5290 -18.0334
17 C8y C 28.7174 -18.7273
18 C8y C 29.9061 -18.0334
19 O1a O 21.6147 -20.0680
20 O5x O 23.9823 -20.0776
21 O1a O 26.3405 -20.0872
22 C1a C 28.7081 -20.0872
23 O2a O 19.2567 -15.8307
24 C6a C 31.0894 -18.7202
25 O6a O 32.2794 -18.0286
26 O6a O 31.0921 -20.0894
27 O5x O 23.9919 -14.4711
28 O1a O 31.0850 -15.8499
29 C1a C 18.0689 -16.5171
BOND 32
1 14 15 1
2 1 8 2
3 15 16 2
4 4 5 1
5 16 17 1
6 8 9 1
7 17 18 2
8 11 19 1
9 9 10 2
10 13 20 2
11 5 6 1
12 15 21 1
13 7 11 1
14 17 22 1
15 6 1 1
16 2 23 1
17 4 12 1
18 6 14 2
19 8 16 1
20 10 18 1
21 11 12 2
22 18 24 1
23 3 4 2
24 24 25 1
25 12 13 1
26 24 26 2
27 2 7 2
28 5 27 2
29 13 14 1
30 10 28 1
31 2 3 1
32 23 29 1
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