SMIRKS
[O:20]=[P:21]([O:22][H:42])([O:23][H:43])[O:24][P:25](=[O:26])([O:27][H:44])[O:28][H:45]>>[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])O[P:21](=[O:20])([O:22][H:42])[O:23][H:43].[H][O:24][P:25](=[O:26])([O:27][H:44])[O:28][H:45]
Derived Operators
EVODEX.1-F68 - Elemental Balance
| O | 4 |
| C | 10 |
| N | 5 |
| H | 13 |
EVODEX.1-M104 - Mass Difference
267.09689000000003
EVODEX.1-E614 - Reaction Operator E
[#8:24]-[#15:25](=[#8:26])(-[#8:27])-[#8:28]-[#15:29]>>[#7](-[#6]1:[#7]:[#6](-[H]):[#7]:[#6]2:[#6]:1:[#7]:[#6](-[H]):[#7]:2-[#6@]1(-[H])-[#8]-[#6@@](-[#6](-[#8]-[#15:25](-[#8:24])(=[#8:26])-[#8:27])(-[H])-[H])(-[H])-[#6@](-[#8]-[H])(-[H])-[#6@]-1(-[#8]-[H])-[H])(-[H])-[H].[#8:28](-[#15:29])-[H]
EVODEX.1-C1075 - Reaction Operator C
[#15:25]-[#8:28]>>[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]-[#15:25].[H]-[#8:28]
EVODEX.1-N1325 - Reaction Operator N
[#8:24]-[#15:25](=[#8:26])(-[#8:27])-[#8:28]-[#15:29]>>[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]-[#15:25](-[#8:24])(=[#8:26])-[#8:27].[H]-[#8:28]-[#15:29]
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-R3913
[H][O:15][C:14]([C@@:13]1([H:35])[O:12][C@:11]([N:10]2:[C:6]3:[N:5]:[C:4]([H:29]):[N:3]:[C:2]([N:1]([H:40])[H:41]):[C:7]:3:[N:8]:[C:9]:2[H:30])([H:31])[C@@:18]([O:19][H:38])([H:39])[C@@:16]1([O:17][H:36])[H:37])([H:33])[H:34].[O:20]=[P:21]([O:22][H:42])([O:23][H:43])[O:24][P:25](=[O:26])([O:27][H:44])[O:28][H:45]>>[N:1]([C:2]1:[N:3]:[C:4]([H:29]):[N:5]:[C:6]2:[C:7]:1:[N:8]:[C:9]([H:30]):[N:10]:2[C@:11]1([H:31])[O:12][C@@:13]([C:14]([O:15][P:21](=[O:20])([O:22][H:42])[O:23][H:43])([H:33])[H:34])([H:35])[C@:16]([O:17][H:36])([H:37])[C@:18]1([O:19][H:38])[H:39])([H:40])[H:41].[H][O:24][P:25](=[O:26])([O:27][H:44])[O:28][H:45]