| Entry |
|
|---|
| Name |
|
|---|
| Formula |
C21H27N3O4S3
|
|---|
| Exact mass |
481.1164
|
|---|
| Mol weight |
481.6518
|
|---|
| Structure |
|
|---|
| Sequence |
0 Sal 1 Cys 2 Cys 3 Man 4 Cys |
|---|
| Gene |
|
|---|
| Organism |
Yersinia pestis |
|---|
| Type |
NRP |
|---|
| Pathway |
| map01053 | Biosynthesis of siderophore group nonribosomal peptides |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Brite |
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C12038
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 31
1 C6a C 35.4021 -22.3063
2 O6a O 36.6141 -21.6066
3 C1z C 34.1900 -21.6066
4 O6a O 35.4021 -23.7058
5 C1x C 34.6256 -20.2765
6 S2x S 33.4903 -19.4508
7 C2y C 32.3551 -20.2765
8 N2x N 32.7905 -21.6066
9 C1c C 29.9311 -20.2765
10 C1d C 31.1432 -19.5767
11 C1y C 28.7191 -19.5767
12 C1y C 25.1691 -18.8658
13 C1y C 26.5686 -18.8658
14 N1x N 27.3928 -20.0088
15 C1x C 28.7236 -18.1769
16 S2x S 27.3928 -17.7443
17 N2x N 24.3446 -17.7228
18 C2y C 23.0135 -18.1552
19 S2x S 23.0138 -19.5547
20 C1x C 24.3446 -19.9872
21 C8x C 19.3784 -16.0568
22 C8x C 19.3784 -17.4563
23 C8x C 20.5933 -18.1560
24 C8y C 21.8011 -17.4563
25 C8y C 21.8011 -16.0568
26 C8x C 20.5933 -15.3570
27 O1a O 29.9240 -21.6760
28 C1a C 31.8324 -18.3540
29 C1a C 30.4329 -18.3540
30 O1a O 23.0137 -15.3578
31 C1a C 35.8148 -20.8285
BOND 34
1 1 4 2
2 11 9 1
3 10 7 1
4 3 5 1
5 5 6 1
6 6 7 1
7 7 8 2
8 17 18 2
9 18 19 1
10 19 20 1
11 13 14 1
12 14 11 1
13 11 15 1
14 15 16 1
15 16 13 1
16 21 22 2
17 22 23 1
18 23 24 2
19 24 25 1
20 25 26 2
21 26 21 1
22 24 18 1
23 12 13 1
24 17 12 1
25 8 3 1
26 9 27 1 #Down
27 10 28 1
28 10 29 1
29 1 3 1
30 25 30 1
31 12 20 1
32 1 2 1
33 9 10 1
34 3 31 1 #Up
|
|---|
