| Entry |
|
|---|
| Name |
2-[(L-Alanin-3-ylcarbamoyl)methyl]-3-(2-aminoethylcarbamoyl)-2-hydroxypropanoate
|
|---|
| Formula |
C11H20N4O7
|
|---|
| Exact mass |
320.1332
|
|---|
| Mol weight |
320.30
|
|---|
| Structure |
|
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| Reaction |
|
|---|
| Pathway |
| map00997 | Biosynthesis of various other secondary metabolites |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00875 | Staphyloferrin B biosynthesis, L-serine => staphyloferrin B |
|
|---|
| Enzyme |
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|---|
| Other DBs |
|
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| LinkDB |
|
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| KCF data |
ATOM 22
1 N1a N 14.4360 -16.2519
2 C1b C 15.6213 -16.9491
3 C1b C 16.8066 -16.2519
4 N1b N 18.0616 -16.9491
5 C5a C 19.2468 -16.2519
6 C1b C 20.4321 -16.9491
7 C1d C 21.6871 -16.2519
8 C1b C 22.8724 -16.9491
9 C5a C 24.0576 -16.2519
10 N1b N 25.2429 -16.9491
11 C1b C 26.4979 -16.2519
12 C1c C 27.6832 -16.9491
13 C6a C 28.8685 -16.2519
14 O6a O 30.1234 -16.9491
15 O5a O 19.2468 -14.9271
16 C6a C 21.6871 -14.7180
17 O6a O 22.8724 -14.0208
18 O6a O 20.5018 -14.0208
19 O1a O 21.6871 -17.8555
20 O5a O 24.0576 -14.9271
21 N1a N 27.6832 -18.3435
22 O6a O 28.8685 -14.8574
BOND 21
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 5 15 2
15 7 16 1
16 16 17 2
17 16 18 1
18 7 19 1
19 9 20 2
20 12 21 1 #Up
21 13 22 2
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