SMIRKS
[H]OP(=O)(O[H])O[C@@:19]1([H:32])[O:20][C@@:21]([C:22]([O:23][H:33])([H:34])[H:35])([H:36])[C@:24]([O:25][H:37])([H:38])[C@@:26]([O:27][H:39])([H:40])[C@:28]1([O:29][H:41])[H:42].[H][O:9][C@@:8]([C@@:6]([C@:4]([C:2](=[O:1])[O:3][H:43])([O:5][H:44])[H:54])([O:7][H:45])[H:53])([C@:10]([O:11][H:47])([C:12]([O:13][H:48])([H:49])[H:50])[H:51])[H:52]>>[O:1]=[C:2]([O:3][H:43])[C@:4]([O:5][H:44])([C@@:6]([O:7][H:45])([C@:8]([O:9][C@:19]1([H:32])[O:20][C@@:21]([C:22]([O:23][H:33])([H:34])[H:35])([H:36])[C@:24]([O:25][H:37])([H:38])[C@@:26]([O:27][H:39])([H:40])[C@:28]1([O:29][H:41])[H:42])([C@:10]([O:11][H:47])([C:12]([O:13][H:48])([H:49])[H:50])[H:51])[H:52])[H:53])[H:54]
Derived Operators
EVODEX.1-F175 - Elemental Balance
| P | -1 |
| O | -4 |
| H | -3 |
EVODEX.1-M10 - Mass Difference
-97.97689
EVODEX.1-E854 - Reaction Operator E
[#8]=[#15](-[#8]-[H])(-[#8]-[H])-[#8]-[#6@:16](-[H:29])(-[#8:17])-[#6@:25].[#8:8](-[#6@:7])-[H]>>[#8:8](-[#6@:7])-[#6:16](-[H:29])(-[#8:17])-[#6@:25]
EVODEX.1-C871 - Reaction Operator C
[H]-[#8:9]-[#6@:8].[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6@:17]>>[#8:9](-[#6@@:8])-[#6@:17]
EVODEX.1-N1093 - Reaction Operator N
[H]-[#8:9]-[#6@:8](-[#6@:6])(-[#6:10])-[H:33].[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6@:17](-[H:42])(-[#8:18])-[#6@:26]>>[#8:9](-[#6@:8](-[#6@:6])(-[#6:10])-[H:33])-[#6@:17](-[H:42])(-[#8:18])-[#6@:26]
EVODEX.1-Em13 - Reaction Operator Em
[#15]-[#8]-[#6:19](-[#8:20])-[#6:26].[H]-[#8:53]-[#6:52]>>[#6:19](-[#8:53]-[#6:52])(-[#8:20])-[#6:26]
EVODEX.1-Nm17 - Reaction Operator Nm
[#15]-[#8]-[#6:19](-[#8:20])-[#6:26].[H]-[#8:53]-[#6:52]>>[#6:19](-[#8:53]-[#6:52])(-[#8:20])-[#6:26]
Source Full Reactions
EVODEX.1-R3151
[O:14]=[P:15]([O:16][H:30])([O:17][H:31])[O:18][C@@:19]1([H:32])[O:20][C@@:21]([C:22]([O:23][H:33])([H:34])[H:35])([H:36])[C@:24]([O:25][H:37])([H:38])[C@@:26]([O:27][H:39])([H:40])[C@:28]1([O:29][H:41])[H:42].[H][O:9][C@@:8]([C@@:6]([C@:4]([C:2](=[O:1])[O:3][H:43])([O:5][H:44])[H:54])([O:7][H:45])[H:53])([C@:10]([O:11][H:47])([C:12]([O:13][H:48])([H:49])[H:50])[H:51])[H:52]>>[H][O:18][P:15](=[O:14])([O:16][H:30])[O:17][H:31].[O:1]=[C:2]([O:3][H:43])[C@:4]([O:5][H:44])([C@@:6]([O:7][H:45])([C@:8]([O:9][C@:19]1([H:32])[O:20][C@@:21]([C:22]([O:23][H:33])([H:34])[H:35])([H:36])[C@:24]([O:25][H:37])([H:38])[C@@:26]([O:27][H:39])([H:40])[C@:28]1([O:29][H:41])[H:42])([C@:10]([O:11][H:47])([C:12]([O:13][H:48])([H:49])[H:50])[H:51])[H:52])[H:53])[H:54]