Entry |
|
Name |
Spinosyn A;
Spinosad factor A
|
Formula |
C41H65NO10
|
Exact mass |
731.4608
|
Mol weight |
731.95
|
Structure |

|
Sequence |
0 Mtk 1 Mae 2 Mak 3 Mtk 4 Mad 5 Mak 6 Mak 7 Mad 8 Mad 9 Mad 10 Man |
Gene |
|
Organism |
Saccharopolyspora spinosa |
Type |
PK |
Other DBs |
|
KCF data |
ATOM 52
1 C1y C 34.0088 -21.9538
2 C1y C 34.0017 -23.3589
3 C1y C 35.2150 -24.0676
4 C1y C 36.4353 -23.3711
5 C1y C 36.4424 -21.9661
6 O2x O 35.2292 -21.2572
7 C1y C 22.1075 -16.3757
8 C1x C 22.1006 -14.9707
9 C1x C 20.8801 -14.2742
10 C1y C 19.6667 -14.9829
11 C1y C 19.6739 -16.3879
12 O2x O 20.8944 -17.0844
13 C1x C 22.1075 -19.1718
14 C1y C 24.5402 -19.1718
15 C1y C 23.3274 -18.4694
16 C1x C 22.1075 -20.5769
17 C1x C 20.8892 -21.2820
18 C1y C 20.8908 -22.6897
19 O7x O 22.1104 -23.3923
20 C5x C 24.5402 -20.5769
21 C7x C 23.3192 -22.6751
22 C1x C 24.5307 -23.3801
23 C2y C 25.6813 -21.2818
24 C1y C 25.6728 -22.6929
25 C2x C 27.0889 -20.8541
26 C1y C 27.9181 -22.0008
27 C1y C 27.0724 -23.1208
28 C2x C 27.6365 -24.4249
29 C2x C 29.0320 -24.5733
30 C1y C 29.3138 -22.1635
31 C1y C 29.8619 -23.4598
32 C1x C 31.2665 -23.3324
33 C1y C 31.5862 -21.9572
34 C1x C 30.3752 -21.2347
35 O2a O 23.3211 -17.0712
36 C1a C 18.6657 -17.3834
37 N1c N 18.4529 -14.2822
38 C1a C 17.2322 -14.9848
39 C1a C 18.4457 -12.8771
40 C1a C 25.7483 -18.4623
41 C1b C 19.6663 -23.3802
42 C1a C 18.4457 -22.6777
43 O5x O 23.1295 -20.5697
44 O6a O 23.2963 -21.5890
45 O2a O 32.7953 -21.2510
46 C1a C 37.6494 -21.2510
47 O2a O 37.6423 -24.0685
48 C1a C 38.8557 -23.3589
49 O2a O 35.2009 -25.4665
50 O2a O 32.7812 -24.0544
51 C1a C 32.7743 -25.4594
52 C1a C 36.4178 -26.1691
BOND 57
1 26 27 1
2 27 28 1
3 28 29 2
4 29 31 1
5 30 26 1
6 20 14 1
7 14 15 1
8 15 13 1
9 2 3 1
10 3 4 1
11 30 31 1
12 31 32 1
13 32 33 1
14 33 34 1
15 34 30 1
16 4 5 1
17 15 35 1 #Down
18 7 35 1 #Down
19 5 6 1
20 11 36 1 #Down
21 16 17 1
22 10 37 1 #Up
23 17 18 1
24 37 38 1
25 18 19 1
26 37 39 1
27 19 21 1
28 14 40 1 #Up
29 7 8 1
30 18 41 1 #Up
31 8 9 1
32 41 42 1
33 9 10 1
34 20 43 2
35 21 22 1
36 21 44 2
37 22 24 1
38 23 20 1
39 10 11 1
40 11 12 1
41 12 7 1
42 33 45 1 #Down
43 1 45 1 #Down
44 23 24 1
45 5 46 1 #Up
46 24 27 1
47 4 47 1 #Down
48 26 25 1
49 47 48 1
50 25 23 2
51 3 49 1 #Up
52 6 1 1
53 2 50 1 #Up
54 1 2 1
55 50 51 1
56 13 16 1
57 49 52 1
|