SMIRKS
[N:1](=[C:2]([N:3]([C:4]([C:5]([S:6](=[O:7])(=[O:8])[O:9][H:57])([H:58])[H:59])([H:60])[H:61])[H:62])[N:10]([P:11](=[O:12])([O:13][H:63])[O:14][H:64])[H:65])[H:66]>>[H][N:10]([C:2](=[N:1][H:66])[N:3]([C:4]([C:5]([S:6](=[O:7])(=[O:8])[O:9][H:57])([H:58])[H:59])([H:60])[H:61])[H:62])[H:65].[H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(N2:C([H]):N:C3:C(N([H])[H]):N:C([H]):N:C:3:2)O[C@]1([H])C([H])([H])OP(=O)(O[H])OP(=O)(O[H])O[P:11](=[O:12])([O:13][H:63])[O:14][H:64]
Derived Operators
EVODEX.1-F385 - Elemental Balance
| P | 2 |
| O | 10 |
| C | 10 |
| N | 5 |
| H | 15 |
EVODEX.1-M27 - Mass Difference
427.02955
EVODEX.1-E1183 - Reaction Operator E
[#6:10]-[#7:12](-[#15:13](=[#8:14])(-[#8:15])-[#8:16])-[H:48]>>[#6:10]-[#7:12](-[H:48])-[H].[#15:13](=[#8:14])(-[#8:15])(-[#8:16])-[#8]-[#15](-[#8]-[#15](-[#8]-[#6](-[#6@@]1(-[H])-[#8]-[#6@](-[#7]2:[#6]3:[#7]:[#6](-[H]):[#7]:[#6](-[#7](-[H])-[H]):[#6]:3:[#7]:[#6]:2-[H])(-[H])-[#6@@](-[#8]-[H])(-[H])-[#6@@]-1(-[#8]-[H])-[H])(-[H])-[H])(=[#8])-[#8]-[H])(=[#8])-[#8]-[H]
EVODEX.1-C885 - Reaction Operator C
[#7:9]-[#15:10]>>[H]-[#7:9].[H]-[#8]-[#6@@]1(-[H])-[#6@@](-[H])(-[#8]-[H])-[#6@](-[H])(-[#7]2:[#6](-[H]):[#7]:[#6]3:[#6](-[#7](-[H])-[H]):[#7]:[#6](-[H]):[#7]:[#6]:2:3)-[#8]-[#6@]-1(-[H])-[#6](-[H])(-[H])-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#15:10]
EVODEX.1-N1107 - Reaction Operator N
[#6:2]-[#7:9](-[#15:10](=[#8:11])(-[#8:12])-[#8:13])-[H:64]>>[H]-[#7:9](-[#6:2])-[H:64].[H]-[#8]-[#6@@]1(-[H])-[#6@@](-[H])(-[#8]-[H])-[#6@](-[H])(-[#7]2:[#6](-[H]):[#7]:[#6]3:[#6](-[#7](-[H])-[H]):[#7]:[#6](-[H]):[#7]:[#6]:2:3)-[#8]-[#6@]-1(-[H])-[#6](-[H])(-[H])-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#15:10](=[#8:11])(-[#8:12])-[#8:13]
EVODEX.1-Em558 - Reaction Operator Em
[#6:2]-[#7:9]-[#15:10](=[#8:11])(-[#8:12])-[#8:13]>>[H]-[#7:9]-[#6:2].[#15]-[#8]-[#15:10](=[#8:11])(-[#8:12])-[#8:13]
EVODEX.1-Nm504 - Reaction Operator Nm
[#6:2]-[#7:9]-[#15:10](=[#8:11])(-[#8:12])-[#8:13]>>[H]-[#7:9]-[#6:2].[#15]-[#8]-[#15:10](=[#8:11])(-[#8:12])-[#8:13]
Source Full Reactions
EVODEX.1-R4200
[H][O:36][P:34]([O:33][P:30]([O:29][C:28]([C@@:27]1([H:50])[O:26][C@:25]([N:24]2:[C:20]3:[N:19]:[C:18]([H:42]):[N:17]:[C:16]([N:15]([H:55])[H:56]):[C:21]:3:[N:22]:[C:23]:2[H:43])([H:44])[C@@:40]([O:41][H:53])([H:54])[C@@:38]1([O:39][H:51])[H:52])([H:48])[H:49])(=[O:31])[O:32][H:45])(=[O:35])[O:37][H:47].[N:1](=[C:2]([N:3]([C:4]([C:5]([S:6](=[O:7])(=[O:8])[O:9][H:57])([H:58])[H:59])([H:60])[H:61])[H:62])[N:10]([P:11](=[O:12])([O:13][H:63])[O:14][H:64])[H:65])[H:66]>>[H][N:10]([C:2](=[N:1][H:66])[N:3]([C:4]([C:5]([S:6](=[O:7])(=[O:8])[O:9][H:57])([H:58])[H:59])([H:60])[H:61])[H:62])[H:65].[P:11](=[O:12])([O:13][H:63])([O:14][H:64])[O:36][P:34]([O:33][P:30]([O:29][C:28]([C@@:27]1([H:50])[O:26][C@:25]([N:24]2:[C:20]3:[N:19]:[C:18]([H:42]):[N:17]:[C:16]([N:15]([H:55])[H:56]):[C:21]:3:[N:22]:[C:23]:2[H:43])([H:44])[C@@:40]([O:41][H:53])([H:54])[C@@:38]1([O:39][H:51])[H:52])([H:48])[H:49])(=[O:31])[O:32][H:45])(=[O:35])[O:37][H:47]