SMIRKS
[H][C@:26]1([O:27][H])[C:24](=[O:25])[C@:22]([C:23]([H:45])([H:46])[H:47])([H:48])[O:21][C@@:20]([O:19][P:16]([O:15][P:12]([O:11][C:10]([C@:9]2([H:55])[C@:7]([O:8][H:40])([H:41])[C:6]([H:38])([H:39])[C@@:5]([N:4]3:[C:3]([H:36]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:34](=[O:35]):[N:33]([H:56]):[C:31]:3=[O:32])([H:37])[O:30]2)([H:53])[H:54])(=[O:13])[O:14][H:42])(=[O:17])[O:18][H:43])([H:44])[C@@:28]1([O:29][H:51])[H:52]>>[H][C:28]1([H:52])[C@:20]([O:19][P:16]([O:15][P:12]([O:11][C:10]([C@:9]2([H:55])[C@:7]([O:8][H:40])([H:41])[C:6]([H:38])([H:39])[C@@:5]([N:4]3:[C:3]([H:36]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:34](=[O:35]):[N:33]([H:56]):[C:31]:3=[O:32])([H:37])[O:30]2)([H:53])[H:54])(=[O:13])[O:14][H:42])(=[O:17])[O:18][H:43])([H:44])[O:21][C@@:22]([C:23]([H:45])([H:46])[H:47])([H:48])[C:24](=[O:25])[C:26]1=[O:27].[H][O:29][H:51]
Derived Operators
EVODEX.1-E241 - Reaction Operator E
[#8:1]=[#6:2]-[#6@:3](-[#8:4]-[H])(-[#6@@:5](-[#8:6]-[H:12])(-[#6@:7])-[H:18])-[H]>>[#8:1]=[#6:2]-[#6:3](=[#8:4])-[#6:5](-[#6@:7])(-[H:18])-[H].[#8:6](-[H:12])-[H]
EVODEX.1-C1449 - Reaction Operator C
([H]-[#6@:26](-[#8:27]-[H])-[#6@@:28](-[#6@@:20])-[#8:29].[#6@:22])>>([H]-[#6:28](-[#6@:20])-[#6:26]=[#8:27].[#6@@:22]).[H]-[#8:29]
EVODEX.1-N1857 - Reaction Operator N
[H]-[#6@:26]1(-[#8:27]-[H])-[#6:24]-[#6@:22](-[#6:23])(-[H:48])-[#8:21]-[#6@@:20](-[#8:19])(-[H:44])-[#6@@:28]-1(-[#8:29]-[H:51])-[H:52]>>[H]-[#6:28]1(-[H:52])-[#6@:20](-[#8:19])(-[H:44])-[#8:21]-[#6@@:22](-[#6:23])(-[H:48])-[#6:24]-[#6:26]-1=[#8:27].[H]-[#8:29]-[H:51]
EVODEX.1-Em611 - Reaction Operator Em
[H]-[#6:3](-[#6:2]=[#8:1])(-[#8:4]-[H])-[#6:5](-[#8:6])-[#6:7]>>[H]-[#6:5](-[#6:3](-[#6:2]=[#8:1])=[#8:4])-[#6:7].[H]-[#8:6]
EVODEX.1-Cm263 - Reaction Operator Cm
[H]-[#6:3](-[#8:4]-[H])-[#6:5]-[#8:6]>>[H]-[#6:5]-[#6:3]=[#8:4].[H]-[#8:6]
EVODEX.1-Nm546 - Reaction Operator Nm
[H]-[#6:3](-[#6:2])(-[#8:4]-[H])-[#6:5](-[#8:6])-[#6:7]>>[H]-[#6:5](-[#6:3](-[#6:2])=[#8:4])-[#6:7].[H]-[#8:6]
Source Full Reactions
EVODEX.1-R7003
[H][C@:26]1([O:27][H])[C:24](=[O:25])[C@:22]([C:23]([H:45])([H:46])[H:47])([H:48])[O:21][C@@:20]([O:19][P:16]([O:15][P:12]([O:11][C:10]([C@:9]2([H:55])[C@:7]([O:8][H:40])([H:41])[C:6]([H:38])([H:39])[C@@:5]([N:4]3:[C:3]([H:36]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:34](=[O:35]):[N:33]([H:56]):[C:31]:3=[O:32])([H:37])[O:30]2)([H:53])[H:54])(=[O:13])[O:14][H:42])(=[O:17])[O:18][H:43])([H:44])[C@@:28]1([O:29][H:51])[H:52]>>[H][C:28]1([H:52])[C@:20]([O:19][P:16]([O:15][P:12]([O:11][C:10]([C@:9]2([H:55])[C@:7]([O:8][H:40])([H:41])[C:6]([H:38])([H:39])[C@@:5]([N:4]3:[C:3]([H:36]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:34](=[O:35]):[N:33]([H:56]):[C:31]:3=[O:32])([H:37])[O:30]2)([H:53])[H:54])(=[O:13])[O:14][H:42])(=[O:17])[O:18][H:43])([H:44])[O:21][C@@:22]([C:23]([H:45])([H:46])[H:47])([H:48])[C:24](=[O:25])[C:26]1=[O:27].[H][O:29][H:51]