Entry |
|
Name |
|
Formula |
C10H12N4O6
|
Exact mass |
284.0757
|
Mol weight |
284.23
|
Structure |
|
Reaction |
|
Pathway |
map01065 | Biosynthesis of alkaloids derived from histidine and purine |
map01110 | Biosynthesis of secondary metabolites |
|
Enzyme |
|
Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Others
Purine alkaloids
C01762 Xanthosine
|
Other DBs |
|
KCF data |
ATOM 20
1 C8y C 19.5636 -12.2457
2 N4y N 20.8454 -12.6584
3 C8y C 19.5636 -10.8896
4 N4x N 18.3865 -12.9296
5 C1y C 20.5066 -15.3271
6 C8x C 21.6407 -11.5738
7 N5x N 20.8517 -10.4767
8 C8y C 18.3865 -10.2179
9 C8y C 17.2278 -12.2457
10 O2x O 19.4033 -14.5258
11 C1y C 20.0997 -16.5843
12 N4x N 17.2278 -10.8896
13 O5x O 18.3802 -9.0212
14 O5x O 16.0630 -12.9112
15 C1y C 18.3309 -15.3087
16 C1y C 18.7624 -16.5843
17 O1a O 20.9010 -17.6629
18 C1b C 17.0491 -14.9019
19 O1a O 17.9797 -17.6752
20 O1a O 16.0630 -15.8016
BOND 22
1 1 2 1
2 1 3 2
3 1 4 1
4 5 2 1 #Up
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 8 12 1
12 8 13 2
13 9 14 2
14 10 15 1
15 11 16 1
16 11 17 1 #Down
17 15 18 1 #Up
18 16 19 1 #Down
19 18 20 1
20 6 7 2
21 9 12 1
22 15 16 1
|