| Entry |
|
|---|
| Name |
Flavin adenine dinucleotide (JAN);
Adeflavin (TN) |
|---|
| Formula |
C27H33N9O15P2
|
|---|
| Exact mass |
785.1571
|
|---|
| Mol weight |
785.5497
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
| Product (DG02941): | D02011<JP> |
| Product (mixture): | D04959<JP> |
|
|---|
| Efficacy |
Supplement (vitamin B2) |
|---|
| Comment |
Coenzyme form of vitamin B2
|
|---|
| Brite |
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Flavin adenine dinucleotide
D00005 Flavin adenine dinucleotide (JAN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 53
1 N4x N 5.3900 -8.0500
2 C8y C 5.3900 -9.4500
3 N5x N 6.6024 -10.1500
4 C8y C 7.8149 -9.4500
5 C8y C 7.8149 -8.0500
6 C8y C 6.6024 -7.3500
7 N4y N 9.0273 -10.1500
8 C8y C 10.2397 -9.4500
9 C8y C 10.2397 -8.0500
10 N5x N 9.0273 -7.3500
11 C8x C 11.4522 -10.1500
12 C8y C 12.6646 -9.4500
13 C8y C 12.6646 -8.0500
14 C8x C 11.4522 -7.3500
15 O5x O 6.6024 -5.9502
16 O5x O 4.1776 -10.1500
17 C1a C 13.8811 -7.3477
18 C1a C 13.8811 -10.1523
19 C1b C 9.0273 -12.4600
20 C1c C 10.2418 -13.1612
21 C1c C 11.4383 -12.4702
22 C1c C 12.6251 -13.1554
23 C1b C 13.8166 -12.4672
24 O2b O 15.0060 -13.1539
25 O1a O 10.2418 -14.5598
26 O1a O 12.6253 -14.5598
27 O1a O 11.4384 -11.0603
28 P1b P 16.4060 -13.1539
29 O2c O 17.8060 -13.1539
30 O1c O 16.4060 -11.7539
31 O1c O 16.4060 -14.5539
32 P1b P 19.2060 -13.1539
33 O2b O 20.6060 -13.1539
34 O1c O 19.2059 -11.7602
35 O1c O 19.2061 -14.5598
36 C1y C 23.0309 -13.1539
37 C1b C 21.8184 -12.4539
38 C1y C 23.4423 -14.4920
39 C1y C 24.8422 -14.5139
40 C1y C 25.2956 -13.1894
41 O2x O 24.1761 -12.3488
42 O1a O 22.6054 -15.6065
43 O1a O 25.6386 -15.6468
44 N5x N 23.1000 -9.1000
45 C8x C 23.1000 -10.5000
46 N5x N 24.3124 -11.2000
47 C8y C 25.5249 -10.5000
48 C8y C 25.5249 -9.1000
49 C8y C 24.3124 -8.4000
50 N4y N 26.8564 -10.9326
51 C8x C 27.6793 -9.8000
52 N5x N 26.8564 -8.6674
53 N1a N 24.3124 -7.0002
BOND 58
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 2
12 8 11 2
13 11 12 1
14 12 13 2
15 13 14 1
16 9 14 2
17 6 15 2
18 2 16 2
19 13 17 1
20 12 18 1
21 7 19 1
22 19 20 1
23 20 21 1
24 21 22 1
25 22 23 1
26 23 24 1
27 20 25 1 #Up
28 22 26 1 #Up
29 21 27 1 #Down
30 24 28 1
31 28 29 1
32 28 30 2
33 28 31 1
34 29 32 1
35 32 33 1
36 32 34 2
37 32 35 1
38 36 37 1 #Up
39 33 37 1
40 36 38 1
41 38 39 1
42 39 40 1
43 40 41 1
44 36 41 1
45 38 42 1 #Down
46 39 43 1 #Down
47 44 45 2
48 45 46 1
49 46 47 2
50 47 48 1
51 48 49 2
52 44 49 1
53 47 50 1
54 50 51 1
55 51 52 2
56 48 52 1
57 40 50 1 #Up
58 49 53 1
|
|---|
