SMIRKS
[O:17]=[P:18]([O:19][H:43])([O:20][H:44])[O:21][P:22](=[O:23])([O:24][H:45])[O:25][P:26](=[O:27])([O:28][H:46])[O:29][H:47]>>[H]O[C@@]1([H])C([H])([H])[C@]([H])(N2:C([H]):C([H]):C(N([H])[H]):N:C:2=O)O[C@]1([H])C([H])([H])O[P:18](=[O:17])([O:19][H:43])[O:20][H:44].[H][O:21][P:22](=[O:23])([O:24][H:45])[O:25][P:26](=[O:27])([O:28][H:46])[O:29][H:47]
Derived Operators
EVODEX.1-F407 - Elemental Balance
| O | 4 |
| C | 9 |
| N | 3 |
| H | 13 |
EVODEX.1-M398 - Mass Difference
227.09069
EVODEX.1-E1213 - Reaction Operator E
[#8:17]=[#15:18](-[#8:19])(-[#8:20])-[#8:21]-[#15:22]>>[#7](-[#6]1:[#6](-[H]):[#6](-[H]):[#7](-[#6@@]2(-[H])-[#6](-[H])(-[H])-[#6@@](-[#8]-[H])(-[H])-[#6@](-[#6](-[#8]-[#15:18](=[#8:17])(-[#8:19])-[#8:20])(-[H])-[H])(-[H])-[#8]-2):[#6](=[#8]):[#7]:1)(-[H])-[H].[#8:21](-[#15:22])-[H]
EVODEX.1-C1316 - Reaction Operator C
[#15:18]-[#8:21]>>[H]-[#8]-[#6@@]1(-[H])-[#6](-[H])(-[H])-[#6@](-[H])(-[#7]2:[#6](-[H]):[#6](-[H]):[#6](-[#7](-[H])-[H]):[#7]:[#6]:2=[#8])-[#8]-[#6@]-1(-[H])-[#6](-[H])(-[H])-[#8]-[#15:18].[H]-[#8:21]
EVODEX.1-N1654 - Reaction Operator N
[#8:17]=[#15:18](-[#8:19])(-[#8:20])-[#8:21]-[#15:22]>>[H]-[#8]-[#6@@]1(-[H])-[#6](-[H])(-[H])-[#6@](-[H])(-[#7]2:[#6](-[H]):[#6](-[H]):[#6](-[#7](-[H])-[H]):[#7]:[#6]:2=[#8])-[#8]-[#6@]-1(-[H])-[#6](-[H])(-[H])-[#8]-[#15:18](=[#8:17])(-[#8:19])-[#8:20].[H]-[#8:21]-[#15:22]
EVODEX.1-Em9 - Reaction Operator Em
[#15:11]-[#8:14]-[#15:15](=[#8:16])(-[#8:17])-[#8:18]>>[#6]-[#8]-[#15:15](=[#8:16])(-[#8:17])-[#8:18].[H]-[#8:14]-[#15:11]
EVODEX.1-Nm10 - Reaction Operator Nm
[#15:11]-[#8:14]-[#15:15](=[#8:16])(-[#8:17])-[#8:18]>>[#6]-[#8]-[#15:15](=[#8:16])(-[#8:17])-[#8:18].[H]-[#8:14]-[#15:11]
Source Full Reactions
EVODEX.1-R4128
[H][O:12][C:11]([C@:10]1([H:40])[C@:8]([O:9][H:35])([H:36])[C:7]([H:33])([H:34])[C@@:6]([N:5]2:[C:4]([H:31]):[C:3]([H:30]):[C:2]([N:1]([H:41])[H:42]):[N:16]:[C:14]:2=[O:15])([H:32])[O:13]1)([H:38])[H:39].[O:17]=[P:18]([O:19][H:43])([O:20][H:44])[O:21][P:22](=[O:23])([O:24][H:45])[O:25][P:26](=[O:27])([O:28][H:46])[O:29][H:47]>>[N:1]([C:2]1:[C:3]([H:30]):[C:4]([H:31]):[N:5]([C@@:6]2([H:32])[C:7]([H:33])([H:34])[C@@:8]([O:9][H:35])([H:36])[C@:10]([C:11]([O:12][P:18](=[O:17])([O:19][H:43])[O:20][H:44])([H:38])[H:39])([H:40])[O:13]2):[C:14](=[O:15]):[N:16]:1)([H:41])[H:42].[H][O:21][P:22](=[O:23])([O:24][H:45])[O:25][P:26](=[O:27])([O:28][H:46])[O:29][H:47]