| Entry |
|
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| Name |
|
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| Formula |
C36H65NO12
|
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| Exact mass |
703.4507
|
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| Mol weight |
703.9008
|
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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 |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C06633 Erythromycin D
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| Other DBs |
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| KCF data |
ATOM 49
1 C1y C 31.0159 -24.2721
2 C1y C 29.7667 -24.9959
3 O2a O 32.2300 -24.9900
4 C1z C 31.0159 -22.8478
5 C1y C 29.7667 -26.4318
6 C1a C 28.7569 -23.9743
7 C1y C 33.4617 -24.2721
8 C1x C 29.7667 -22.1356
9 C1a C 32.2243 -22.3750
10 O1a O 31.2260 -21.4001
11 O2a O 31.0043 -27.0564
12 C1y C 28.5350 -27.1439
13 C1y C 34.1622 -25.4979
14 O2x O 34.1680 -23.0638
15 C1y C 29.7667 -20.6937
16 C1y C 31.6871 -28.2356
17 C7x C 27.3034 -26.4318
18 C1a C 28.5350 -28.5859
19 C1y C 35.5632 -25.5038
20 O1a O 33.3683 -26.6361
21 C1y C 35.5689 -23.0638
22 C5x C 28.5350 -19.9757
23 C1a C 31.0159 -19.9757
24 C1x C 31.6814 -29.5956
25 O2x O 32.8604 -27.5585
26 O7x O 27.3034 -24.9959
27 O6a O 26.4687 -27.0097
28 C1x C 36.2694 -24.2779
29 N1c N 36.7014 -26.5369
30 C1a C 36.2694 -21.8321
31 C1y C 27.3034 -20.6937
32 O5x O 28.5350 -18.5515
33 C1z C 32.8430 -30.2844
34 C1y C 34.0337 -28.2531
35 C1y C 26.0484 -24.2721
36 C1a C 37.7929 -25.8190
37 C1a C 37.8630 -27.2491
38 C1y C 27.3034 -22.1356
39 C1a C 26.0484 -19.9757
40 C1y C 34.0280 -29.6190
41 C1a C 33.7068 -31.3409
42 O1a O 32.0083 -31.4110
43 C1a C 35.1953 -27.5585
44 C1y C 26.0484 -22.8478
45 C1b C 24.8050 -24.9843
46 O1a O 28.5292 -22.8420
47 O1a O 35.1896 -30.2787
48 C1a C 24.8458 -22.0422
49 C1a C 24.7933 -26.4143
BOND 51
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 45 49 1
49 21 28 1
50 34 40 1
51 38 44 1
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