| Entry |
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|---|
| Name |
|
|---|
| Formula |
C22H26N2O6S3
|
|---|
| Exact mass |
510.0953
|
|---|
| Mol weight |
510.6466
|
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| Structure |
|
|---|
| Sequence |
0 Ala 1 Cys 2 Mad 3 Man 4 Mad 5 Mte 6 Man 7 Man |
|---|
| Gene |
|
|---|
| Organism |
Streptomyces atroolivaceus |
|---|
| Type |
PKNRP |
|---|
| Other DBs |
|
|---|
| LinkDB |
|
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| KCF data |
ATOM 33
1 C8x C 26.8800 -26.4600
2 S2x S 28.2800 -26.4600
3 C8y C 28.7000 -25.1300
4 N5x N 27.5800 -24.2900
5 C8y C 26.4600 -25.1300
6 C2x C 25.1300 -24.7100
7 C1y C 29.8900 -24.4300
8 N1x N 31.1500 -25.1300
9 C5x C 32.3400 -24.4300
10 O5x O 33.5300 -25.1300
11 C1a C 29.8900 -23.0300
12 C1x C 32.3400 -23.0300
13 C2x C 25.1300 -23.3100
14 C2x C 26.3200 -22.6100
15 C2x C 26.3200 -21.2100
16 C5x C 27.5100 -20.5100
17 C1y C 28.7000 -21.2100
18 O5x O 27.5100 -19.1100
19 C2x C 29.8900 -20.5100
20 O1a O 28.7000 -22.6100
21 C2y C 31.0800 -21.2100
22 C1x C 32.2700 -20.5100
23 C1a C 31.0800 -22.6100
24 C1x C 33.4600 -21.2100
25 C1z C 34.1600 -22.4000
26 S3x S 36.3300 -23.1000
27 C5x C 36.3300 -21.7000
28 C1z C 35.0000 -21.2800
29 S3x S 35.0000 -23.5200
30 O3c O 34.5800 -24.8500
31 O5x O 37.4592 -20.8724
32 O1a O 35.3623 -19.9277
33 C1a C 33.7876 -20.5800
BOND 35
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 1 5 2
6 5 6 1
7 3 7 1
8 7 8 1
9 8 9 1
10 9 10 2
11 7 11 1 #Up
12 9 12 1
13 6 13 2
14 13 14 1
15 14 15 2
16 15 16 1
17 16 17 1
18 16 18 2
19 17 19 1
20 17 20 1 #Up
21 19 21 2
22 21 22 1
23 21 23 1
24 22 24 1
25 25 24 1 #Up
26 25 12 1 #Down
27 26 27 1
28 27 28 1
29 28 25 1
30 25 29 1
31 26 29 1
32 29 30 2
33 27 31 2
34 28 32 1 #Up
35 28 33 1 #Down
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