| Entry |
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| Name |
4-Demethylpremithramycinone
|
|---|
| Formula |
C20H16O9
|
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| Exact mass |
400.0794
|
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| Mol weight |
400.33
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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 |
| M00782 | Mithramycin biosynthesis, 4-demethylpremithramycinone => mithramycin |
|
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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
C12382 4-Demethylpremithramycinone
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 29
1 O1a O 33.3282 -18.2055
2 C1x C 28.5943 -18.2055
3 C8y C 22.6780 -18.8669
4 C8x C 23.8640 -18.1932
5 C8y C 25.0497 -18.8762
6 C8x C 26.2262 -18.2028
7 C8y C 27.3419 -18.8762
8 C8x C 22.6835 -20.3016
9 C1y C 29.7837 -18.8858
10 C1y C 30.9695 -18.2123
11 C2y C 32.1459 -18.8858
12 C8y C 23.8640 -20.9942
13 C8y C 25.0402 -20.3111
14 C8y C 26.2166 -21.0037
15 C8y C 27.4024 -20.3207
16 C5x C 28.5884 -21.0037
17 C1z C 29.7741 -20.3300
18 C5x C 30.9599 -21.0131
19 C2y C 32.1363 -20.3300
20 C5a C 33.3221 -21.0226
21 C1a C 34.5081 -20.3396
22 O1a O 23.8544 -22.3602
23 O1a O 26.2166 -22.3698
24 O5x O 28.5788 -22.3791
25 O5x O 30.9506 -22.3791
26 O5a O 33.3127 -22.3887
27 O1a O 21.4827 -18.1932
28 O1a O 29.7646 -21.7152
29 O1a O 30.9599 -16.8271
BOND 32
1 3 4 1
2 15 16 1
3 2 9 1
4 16 17 1
5 5 6 1
6 17 18 1
7 9 10 1
8 18 19 1
9 19 20 1
10 10 11 1
11 20 21 1
12 11 1 1
13 12 22 1
14 6 7 2
15 14 23 1
16 8 12 1
17 16 24 2
18 7 2 1
19 18 25 2
20 12 13 2
21 20 26 2
22 4 5 2
23 3 27 1
24 5 13 1
25 7 15 1
26 9 17 1
27 11 19 2
28 13 14 1
29 3 8 2
30 17 28 1 #Down
31 14 15 2
32 10 29 1 #Down
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