| Entry |
|
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| Name |
|
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| Formula |
C36H65NO13
|
|---|
| Exact mass |
719.4456
|
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| Mol weight |
719.90
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| Structure |
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| Reaction |
|
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| Pathway |
| map00522 | Biosynthesis of 12-, 14- and 16-membered macrolides |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Module |
| M00774 | Erythromycin biosynthesis, propanoyl-CoA + methylmalonyl-CoA => deoxyerythronolide B => erythromycin A/B |
|
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| Enzyme |
|
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C06616 Erythromycin C
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 50
1 C1y C 30.9749 -24.2720
2 C1y C 29.7258 -25.0016
3 O2a O 32.1891 -24.9957
4 C1z C 30.9749 -22.8477
5 C1y C 29.7258 -26.4317
6 C1a C 28.7158 -23.9799
7 C1y C 33.4208 -24.2720
8 C1x C 29.7258 -22.1355
9 C1a C 32.1833 -22.3748
10 O1a O 31.1850 -21.4058
11 O2a O 30.9633 -27.0564
12 C1y C 28.4940 -27.1439
13 C1y C 34.1272 -25.5035
14 O2x O 34.1272 -23.0637
15 C1y C 29.7258 -20.6994
16 C1y C 31.6462 -28.2355
17 C7x C 27.2623 -26.4317
18 C1a C 28.4940 -28.5917
19 C1y C 35.5281 -25.5035
20 O1a O 33.3274 -26.6420
21 C1y C 35.5281 -23.0637
22 C5x C 28.4940 -19.9755
23 C1a C 30.9749 -19.9755
24 C1x C 31.6404 -29.6015
25 O2x O 32.8195 -27.5643
26 O7x O 27.2623 -25.0016
27 O6a O 26.4275 -27.0097
28 C1x C 36.2286 -24.2777
29 N1c N 36.6666 -26.5369
30 C1a C 36.2286 -21.8319
31 C1y C 27.2623 -20.6994
32 O5x O 28.4940 -18.5513
33 C1z C 32.8021 -30.2845
34 C1y C 33.9988 -28.2588
35 C1y C 26.0072 -24.2720
36 C1a C 37.7522 -25.8189
37 C1a C 37.8223 -27.2490
38 C1y C 27.2623 -22.1355
39 C1a C 26.0072 -19.9755
40 C1y C 33.9871 -29.6191
41 C1a C 33.6659 -31.3411
42 O1a O 31.9673 -31.4112
43 C1a C 35.1547 -27.5583
44 C1z C 26.0072 -22.8477
45 C1b C 24.7638 -24.9841
46 O1a O 28.4881 -22.8417
47 O1a O 35.1487 -30.2845
48 C1a C 24.8047 -22.0479
49 O1a O 26.0597 -21.4524
50 C1a C 24.7521 -26.4200
BOND 52
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 2 5 1
5 2 6 1 #Down
6 7 3 1 #Down
7 4 8 1
8 4 9 1 #Down
9 4 10 1 #Up
10 5 11 1 #Down
11 5 12 1
12 7 13 1
13 7 14 1
14 8 15 1
15 16 11 1 #Down
16 12 17 1
17 12 18 1 #Up
18 13 19 1
19 13 20 1 #Up
20 14 21 1
21 15 22 1
22 15 23 1 #Down
23 16 24 1
24 16 25 1
25 17 26 1
26 17 27 2
27 19 28 1
28 19 29 1 #Down
29 21 30 1 #Down
30 22 31 1
31 22 32 2
32 24 33 1
33 25 34 1
34 26 35 1
35 29 36 1
36 29 37 1
37 31 38 1
38 31 39 1 #Up
39 33 40 1
40 33 41 1 #Up
41 33 42 1 #Down
42 34 43 1 #Up
43 35 44 1
44 35 45 1 #Down
45 38 46 1 #Up
46 40 47 1 #Down
47 44 48 1 #Down
48 44 49 1 #Up
49 45 50 1
50 21 28 1
51 34 40 1
52 38 44 1
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