COMPOUND: C16071
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Entry
C16071 Compound
Name
Riboflavin cyclic-4',5'-phosphate
Formula
C17H19N4O8P
Exact mass
438.0941
Mol weight
438.3285
Structure
Mol file
KCF file
DB search
Reaction
R07636
Enzyme
4.6.1.15
Other DBs
PubChem:
47205381
ChEBI:
15045
NIKKAJI:
J950.408G
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KCF data
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ATOM 30
1 N4x N 13.3348 -17.2446
2 C8y C 13.3348 -18.6092
3 N5x N 14.4947 -19.2915
4 C8y C 15.7229 -18.6092
5 C8y C 15.7229 -17.2446
6 C8y C 14.4947 -16.5623
7 N4y N 16.8828 -19.2915
8 C8y C 18.0427 -18.6092
9 C8y C 18.0427 -17.2446
10 N5x N 16.8828 -16.5623
11 C8x C 19.2709 -19.2915
12 C8y C 20.4308 -18.6092
13 C8y C 20.4308 -17.2446
14 C8x C 19.2709 -16.5623
15 O5x O 14.4947 -15.1976
16 O5x O 12.1748 -19.2915
17 C1a C 21.5908 -16.5623
18 C1a C 21.5908 -19.2915
19 C1b C 16.8828 -21.5432
20 C1c C 18.0427 -22.2255
21 C1c C 19.2027 -21.5432
22 C1y C 20.3626 -22.2255
23 C1x C 21.5225 -21.5432
24 O2x O 22.6825 -22.2255
25 O1a O 18.0427 -23.5901
26 O2x O 20.3626 -23.5901
27 O1a O 19.2027 -20.1785
28 P1b P 22.6726 -23.5901
29 O1c O 24.0726 -23.5901
30 O1c O 22.6726 -24.9901
BOND 33
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 26 28 1
31 24 28 1
32 28 29 2
33 28 30 1
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