| Entry |
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| Name |
|
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| Formula |
C49H86N2O17
|
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| Exact mass |
974.5926
|
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| Mol weight |
975.21
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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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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C11988 Megalomicin C2
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 68
1 O2x O 24.9943 -12.8682
2 C1y C 25.7011 -14.1004
3 C1y C 25.7011 -11.6592
4 C1x C 27.1028 -14.1004
5 C1y C 27.1028 -11.6592
6 C1y C 27.8037 -12.8740
7 O1a O 27.8037 -10.4268
8 N1c N 29.2163 -12.8709
9 C1a C 25.0043 -10.4444
10 C1a C 29.9251 -14.0928
11 C1a C 29.9201 -11.6461
12 C1y C 24.1366 -17.5073
13 C1y C 22.8867 -18.2374
14 O2a O 25.3514 -18.2314
15 C1z C 24.1366 -16.0822
16 C1y C 22.8867 -19.6683
17 C1a C 21.8762 -17.2152
18 C1y C 26.5838 -17.5073
19 C1x C 22.8867 -15.3696
20 C1a C 25.3456 -15.6091
21 O2a O 24.3468 -14.6396
22 O2a O 24.1249 -20.2933
23 C1y C 21.6543 -20.3809
24 C1y C 27.2906 -18.7396
25 O2x O 27.2906 -16.2983
26 C1y C 22.8867 -13.9328
27 C1y C 24.8082 -21.4730
28 C7x C 20.4219 -19.6683
29 C1a C 21.6543 -21.8294
30 C1y C 28.6922 -18.7396
31 O1a O 26.4903 -19.8787
32 C1y C 28.6922 -16.2983
33 C5x C 21.6543 -13.2085
34 C1a C 23.5766 -12.7885
35 C1x C 24.8024 -22.8398
36 O2x O 25.9821 -20.8014
37 O7x O 20.4219 -18.2374
38 O6a O 19.4467 -20.3165
39 C1x C 29.3931 -17.5131
40 N1c N 29.8313 -19.7735
41 C1a C 29.3931 -15.0659
42 C1y C 20.4219 -13.9328
43 O5x O 21.6543 -11.7835
44 C1z C 25.9647 -23.5232
45 C1y C 27.1620 -21.4964
46 C1y C 19.1661 -17.5073
47 C1a C 30.9175 -19.0551
48 C1a C 30.9877 -20.4861
49 C1y C 20.4219 -15.3696
50 C1a C 19.1661 -13.2085
51 C1y C 27.1504 -22.8574
52 C1a C 26.8290 -24.7903
53 O7a O 25.1295 -24.6504
54 C1a C 28.3186 -20.5855
55 C1z C 19.1661 -16.0822
56 C1b C 17.9220 -18.2199
57 O1a O 21.6484 -16.0763
58 O7a O 28.3126 -23.5232
59 C1a C 17.9630 -15.2820
60 O1a O 19.2186 -14.6862
61 C1a C 17.9104 -19.6566
62 C7a C 29.4704 -22.8496
63 C1b C 30.6326 -23.5154
64 O6a O 29.4659 -21.7201
65 C7a C 23.9181 -23.9494
66 C1a C 22.7113 -24.6480
67 O6a O 23.9179 -22.5520
68 C1a C 31.8405 -22.8126
BOND 71
1 1 3 1
2 8 10 1
3 2 4 1
4 8 11 1
5 3 5 1
6 4 6 1
7 12 13 1
8 12 14 1 #Down
9 12 15 1
10 13 16 1
11 13 17 1 #Down
12 18 14 1 #Down
13 15 19 1
14 15 20 1 #Down
15 15 21 1 #Up
16 16 22 1 #Down
17 16 23 1
18 18 24 1
19 18 25 1
20 19 26 1
21 27 22 1 #Down
22 23 28 1
23 23 29 1 #Up
24 24 30 1
25 24 31 1 #Up
26 25 32 1
27 26 33 1
28 26 34 1 #Down
29 27 35 1
30 27 36 1
31 28 37 1
32 28 38 2
33 30 39 1
34 30 40 1 #Down
35 32 41 1 #Down
36 33 42 1
37 33 43 2
38 35 44 1
39 36 45 1
40 37 46 1
41 40 47 1
42 40 48 1
43 42 49 1
44 42 50 1 #Up
45 44 51 1
46 44 52 1 #Up
47 44 53 1 #Down
48 45 54 1 #Up
49 46 55 1
50 46 56 1 #Down
51 49 57 1 #Up
52 51 58 1 #Down
53 55 59 1 #Down
54 55 60 1 #Up
55 56 61 1
56 32 39 1
57 45 51 1
58 49 55 1
59 2 21 1 #Down
60 5 7 1 #Down
61 58 62 1
62 5 6 1
63 62 63 1
64 62 64 2
65 53 65 1
66 6 8 1 #Down
67 65 66 1
68 1 2 1
69 65 67 2
70 3 9 1 #Up
71 63 68 1
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