| Entry |
|
|---|
| Name |
Deamino-NAD+;
Deamido-NAD+;
Deamido-NAD;
Nicotinic acid adenine dinucleotide
|
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| Formula |
C21H27N6O15P2
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| Exact mass |
665.1010
|
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| Mol weight |
665.42
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| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00760 | Nicotinate and nicotinamide metabolism |
|
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| Module |
| M00115 | NAD biosynthesis, aspartate => quinolinate => NAD |
| M00912 | NAD biosynthesis, tryptophan => quinolinate => NAD |
|
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| Enzyme |
|
|---|
| Other DBs |
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| KCF data |
ATOM 44
1 N4y N 31.3662 -15.7713
2 C8y C 30.0919 -15.3680
3 C1y C 31.0214 -18.0103
4 C8x C 32.1320 -14.6782
5 C8y C 30.0802 -14.0350
6 N5x N 28.9169 -16.0519
7 O2x O 29.9224 -17.2094
8 C1y C 30.6239 -19.2672
9 N5x N 31.3488 -13.6200
10 C8y C 28.9052 -13.3569
11 C8x C 27.7419 -15.3972
12 C1y C 28.8350 -17.9869
13 C1y C 29.2617 -19.2672
14 O1a O 31.4130 -20.3543
15 N5x N 27.7359 -14.0409
16 N1a N 28.8993 -12.0883
17 C1b C 27.3624 -17.5193
18 O1a O 28.4842 -20.3543
19 O2b O 26.2809 -17.4725
20 P1b P 24.7669 -17.4668
21 O2c O 22.9606 -17.4725
22 O1c O 24.7669 -19.0334
23 O1c O 24.7669 -15.9702
24 P1b P 21.2829 -17.4668
25 O2b O 19.8389 -17.4785
26 O1c O 21.2887 -18.9574
27 O1c O 21.2829 -15.9644
28 C1b C 18.5118 -17.5309
29 C1y C 17.2666 -17.9693
30 O2x O 16.1501 -17.2269
31 C1y C 16.9101 -19.3314
32 C1y C 15.0744 -18.0628
33 C1y C 15.5245 -19.3665
34 O1a O 17.7109 -20.3252
35 N5y N 13.7475 -16.7709 #+
36 O1a O 14.7705 -20.4188
37 C8x C 14.7764 -16.0168
38 C8x C 12.4673 -16.0693
39 C8y C 14.7822 -14.6665
40 C8x C 12.4496 -14.8067
41 C8x C 13.5838 -14.0701
42 C6a C 15.8987 -13.9299
43 O6a O 15.8987 -12.7373
44 O6a O 17.0971 -14.5319
BOND 48
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 8 13 1
13 8 14 1 #Down
14 10 15 2
15 10 16 1
16 12 17 1 #Up
17 13 18 1 #Down
18 17 19 1
19 19 20 1
20 20 21 1
21 20 22 1
22 20 23 2
23 21 24 1
24 24 25 1
25 24 26 1
26 24 27 2
27 25 28 1
28 29 28 1 #Down
29 29 30 1
30 29 31 1
31 30 32 1
32 31 33 1
33 31 34 1 #Up
34 32 35 1 #Down
35 33 36 1 #Up
36 35 37 1
37 35 38 2
38 37 39 2
39 38 40 1
40 39 41 1
41 39 42 1
42 42 43 1
43 42 44 2
44 5 9 1
45 11 15 1
46 12 13 1
47 32 33 1
48 40 41 2
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