COMPOUND: C20562
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Entry
C20562 Compound
Name
N-[(7,8-Dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate
Formula
C18H23N6O8P
Exact mass
482.1315
Mol weight
482.38
Structure
Mol file
KCF file
DB search
Reaction
R10339
Pathway
map00790
Folate biosynthesis
map01240
Biosynthesis of cofactors
Enzyme
2.5.1.105
Other DBs
PubChem:
172232299
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KCF data
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ATOM 33
1 N4x N 24.3104 -12.5968
2 C8y C 24.2859 -11.1975
3 N5x N 23.0969 -10.4585
4 C8y C 21.8623 -11.1187
5 C8y C 21.8168 -12.5180
6 C8y C 23.0059 -13.2570
7 N1x N 20.6733 -10.3797
8 C1x C 19.3687 -11.0399
9 C2y C 19.3932 -12.4391
10 N2x N 20.5822 -13.1782
11 O5x O 23.0304 -14.6561
12 N1a N 25.5204 -10.5373
13 C1b C 18.1738 -13.0914
14 C1y C 11.5372 -14.2821
15 O2x O 10.3802 -13.4464
16 C1y C 11.1129 -15.5932
17 C1y C 9.2490 -14.2626
18 C1y C 9.6988 -15.5932
19 O1a O 11.9421 -16.7180
20 C1b C 7.9248 -13.8513
21 O1a O 8.8954 -16.7310
22 O2b O 7.0892 -14.9569
23 P1b P 5.6817 -14.9504
24 O1c O 4.2869 -14.9504
25 O1c O 5.6817 -16.3453
26 O1c O 5.6752 -13.5493
27 C8y C 12.8813 -13.8425
28 C8x C 13.9222 -14.7761
29 C8x C 15.2571 -14.3396
30 C8y C 15.5465 -12.9651
31 C8x C 14.5057 -12.0315
32 C8x C 13.1708 -12.4681
33 N1b N 16.8691 -12.3929
BOND 36
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 2
11 5 10 1
12 6 11 2
13 2 12 1
14 9 13 1
15 14 15 1
16 14 16 1
17 15 17 1
18 16 18 1
19 16 19 1 #Down
20 17 20 1 #Up
21 18 21 1 #Down
22 20 22 1
23 22 23 1
24 23 24 1
25 23 25 1
26 23 26 2
27 17 18 1
28 14 27 1 #Up
29 27 28 2
30 28 29 1
31 29 30 2
32 30 31 1
33 31 32 2
34 27 32 1
35 30 33 1
36 13 33 1
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