| Entry |
|
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| Name |
1-(5'-Phosphoribosyl)-5-amino-4-(N-succinocarboxamide)-imidazole;
1-(5'-Phosphoribosyl)-4-(N-succinocarboxamide)-5-aminoimidazole;
5'-Phosphoribosyl-4-(N-succinocarboxamide)-5-aminoimidazole;
(S)-2-[5-Amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamido]succinate;
SAICAR
|
|---|
| Formula |
C13H19N4O12P
|
|---|
| Exact mass |
454.0737
|
|---|
| Mol weight |
454.2833
|
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| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00048 | De novo purine biosynthesis, PRPP + glutamine => IMP |
|
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| Enzyme |
|
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| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 30
1 N4y N 28.3768 -16.2959
2 C1y C 27.4333 -17.5036
3 C8y C 29.7545 -16.2959
4 C8x C 27.9616 -14.9873
5 O2x O 26.3135 -16.7047
6 C1y C 27.0055 -18.8121
7 C8y C 30.1760 -14.9873
8 N1a N 30.5598 -17.4030
9 N5x N 29.0626 -14.1884
10 C1y C 25.2190 -17.5036
11 C1y C 25.6342 -18.8121
12 O1a O 27.8108 -19.9193
13 C1b C 23.9168 -17.0759
14 O1a O 24.8227 -19.9193
15 O2b O 23.6400 -15.7360
16 P1b P 22.2623 -15.7360
17 O1c O 20.8972 -15.7360
18 O1c O 22.2623 -14.3645
19 O1c O 22.2561 -17.1009
20 C5a C 31.3824 -14.2800
21 N1b N 32.5949 -14.9800
22 C1c C 33.8073 -14.2800
23 C1b C 35.0197 -14.9800
24 C6a C 36.2322 -14.2800
25 O6a O 37.4446 -14.9800
26 O5a O 31.3778 -12.8801
27 O6a O 36.2322 -13.0203
28 C6a C 33.8073 -12.8800
29 O6a O 35.0218 -12.1788
30 O6a O 32.5969 -12.1812
BOND 31
1 2 1 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 1
11 6 12 1 #Down
12 10 13 1 #Up
13 11 14 1 #Down
14 13 15 1
15 15 16 1
16 16 17 1
17 16 18 1
18 16 19 2
19 7 9 1
20 10 11 1
21 7 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 20 26 2
28 24 27 2
29 22 28 1 #Down
30 28 29 1
31 28 30 2
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