SMIRKS
[C:1]([O:2][C@@:3]([C@:4]([O:5][H:30])([C@@:6]([C:7]([O:8][H:31])([H:32])[H:33])([O:9][C@@:10]1([H:34])[O:11][C@@:12]([C:13]([O:14][H:35])([H:36])[H:37])([H:38])[C@:15]([O:16][H:39])([H:40])[C@@:17]([O:18][H:41])([H:42])[C@@:19]1([O:20][H:43])[H:44])[H:45])[H:46])([C@@:21]([O:22][H:47])([C:23](=[O:24])[H:48])[H:49])[H:50])([H:51])([H:52])[H:53]>>[H]OP(=O)(O[H])O[C@@:10]1([H:34])[O:11][C@@:12]([C:13]([O:14][H:35])([H:36])[H:37])([H:38])[C@:15]([O:16][H:39])([H:40])[C@@:17]([O:18][H:41])([H:42])[C@@:19]1([O:20][H:43])[H:44].[H][O:9][C@@:6]([C@:4]([C@:3]([O:2][C:1]([H:51])([H:52])[H:53])([C@@:21]([O:22][H:47])([C:23](=[O:24])[H:48])[H:49])[H:50])([O:5][H:30])[H:46])([C:7]([O:8][H:31])([H:32])[H:33])[H:45]
Derived Operators
EVODEX.1-F305 - Elemental Balance
| P | 1 |
| O | 4 |
| H | 3 |
EVODEX.1-M26 - Mass Difference
97.97689
EVODEX.1-E1075 - Reaction Operator E
[#6:12]-[#8:13]-[#6@@:14](-[H:32])(-[#8:15])-[#6@:23]>>[#8]=[#15](-[#8]-[#6@@:14](-[H:32])(-[#8:15])-[#6@:23])(-[#8]-[H])-[#8]-[H].[#6:12]-[#8:13]-[H]
EVODEX.1-C1256 - Reaction Operator C
([#8:9]-[#6@@:10].[#6@@:3])>>[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6@@:10].([H]-[#8:9].[#6@:3])
EVODEX.1-N1565 - Reaction Operator N
[#8:2]-[#6@@:3](-[#6@:4]-[#6@@:6]-[#8:9]-[#6@@:10](-[H:34])(-[#8:11])-[#6@@:19])(-[#6@@:21])-[H:50]>>[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6@@:10](-[H:34])(-[#8:11])-[#6@@:19].[H]-[#8:9]-[#6@@:6]-[#6@:4]-[#6@:3](-[#8:2])(-[#6@@:21])-[H:50]
EVODEX.1-Em61 - Reaction Operator Em
[#6:34]-[#8:35]-[#6:36](-[#8:37])-[#6:45]>>[#15]-[#8]-[#6:36](-[#8:37])-[#6:45].[H]-[#8:35]-[#6:34]
EVODEX.1-Nm73 - Reaction Operator Nm
[#6:34]-[#8:35]-[#6:36](-[#8:37])-[#6:45]>>[#15]-[#8]-[#6:36](-[#8:37])-[#6:45].[H]-[#8:35]-[#6:34]
Source Full Reactions
EVODEX.1-R3118
[C:1]([O:2][C@@:3]([C@:4]([O:5][H:30])([C@@:6]([C:7]([O:8][H:31])([H:32])[H:33])([O:9][C@@:10]1([H:34])[O:11][C@@:12]([C:13]([O:14][H:35])([H:36])[H:37])([H:38])[C@:15]([O:16][H:39])([H:40])[C@@:17]([O:18][H:41])([H:42])[C@@:19]1([O:20][H:43])[H:44])[H:45])[H:46])([C@@:21]([O:22][H:47])([C:23](=[O:24])[H:48])[H:49])[H:50])([H:51])([H:52])[H:53].[H][O:27][P:26](=[O:25])([O:28][H:55])[O:29][H:56]>>[C@:10]1([O:27][P:26](=[O:25])([O:28][H:55])[O:29][H:56])([H:34])[O:11][C@@:12]([C:13]([O:14][H:35])([H:36])[H:37])([H:38])[C@:15]([O:16][H:39])([H:40])[C@@:17]([O:18][H:41])([H:42])[C@@:19]1([O:20][H:43])[H:44].[H][O:9][C@@:6]([C@:4]([C@:3]([O:2][C:1]([H:51])([H:52])[H:53])([C@@:21]([O:22][H:47])([C:23](=[O:24])[H:48])[H:49])[H:50])([O:5][H:30])[H:46])([C:7]([O:8][H:31])([H:32])[H:33])[H:45]