| Entry |
|
|---|
| Name |
CDP-choline;
Cytidine 5'-diphosphocholine;
Citicoline
|
|---|
| Formula |
C14H26N4O11P2
|
|---|
| Exact mass |
488.1073
|
|---|
| Mol weight |
488.324
|
|---|
| Structure |
     |
|---|
| Remark |
|
|---|
| Reaction |
|
|---|
| Pathway |
| Glycerophospholipid metabolism | | Metabolic pathways |
|
|---|
| Enzyme |
|
|---|
| Other DBs |
CAS: 987-78-0 PubChem: ChEBI: KNApSAcK: PDB-CCD: 3DMET: NIKKAJI: |
|---|
| KCF data |
ATOM 31
1 C1y C 14.9800 -22.3300
2 C1y C 16.3800 -22.3300
3 C1y C 16.8126 -20.9985
4 O2x O 15.6800 -20.1756
5 C1y C 14.5474 -20.9985
6 N4y N 18.0251 -18.8985
7 C1b C 13.3349 -20.2985
8 O2b O 12.1225 -20.9985
9 O1a O 14.1571 -23.4626
10 O1a O 17.2029 -23.4626
11 C8x C 19.2375 -18.1985
12 C8x C 19.2375 -16.7985
13 C8y C 18.0251 -16.0985
14 N5x N 16.8127 -16.7985
15 C8y C 16.8127 -18.1985
16 O5x O 15.5901 -18.9044
17 N1a N 18.0251 -14.7004
18 P1b P 10.7225 -20.9985
19 O2c O 9.3225 -20.9985
20 P1b P 7.9225 -20.9985
21 O2b O 6.5225 -20.9985
22 O1c O 10.7225 -19.6001
23 O1c O 10.7225 -22.3999
24 O1c O 7.9225 -19.6001
25 O1c O 7.9225 -22.3999 #-
26 C1b C 5.3101 -20.2985
27 C1b C 4.0976 -20.9985
28 N1d N 2.9103 -20.3127 #+
29 C1a C 1.7151 -19.6221
30 C1a C 2.2233 -21.5026
31 C1a C 3.6232 -19.0780
BOND 32
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 3 6 1 #Up
7 5 7 1 #Up
8 7 8 1
9 1 9 1 #Down
10 2 10 1 #Down
11 6 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 6 15 1
17 15 16 2
18 13 17 1
19 8 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 18 22 2
24 18 23 1
25 20 24 2
26 20 25 1
27 21 26 1
28 26 27 1
29 27 28 1
30 28 29 1
31 28 30 1
32 28 31 1
|
|---|
