SMIRKS
[O:6]([C:7]([C@@:8]1([H:32])[O:9][C@:10]([O:11][C@@:12]2([H:33])[C@@:13]([O:14][H:34])([H:35])[C:15]([F:16])([H:36])[C@:17]([O:18][H:37])([H:38])[O:19][C@@:20]2([C:21]([O:22][H:39])([H:40])[H:41])[H:42])([H:43])[C@:23]([O:24][H:44])([H:45])[C@:25]([O:26][H:46])([H:47])[C@@:27]1([O:28][H:48])[H:49])([H:50])[H:51])[H:52]>>[H]OP(=O)(O[H])O[C@@:10]1([H:43])[O:9][C@@:8]([C:7]([O:6][H:52])([H:50])[H:51])([H:32])[C@:27]([O:28][H:48])([H:49])[C@@:25]([O:26][H:46])([H:47])[C@@:23]1([O:24][H:44])[H:45].[H][O:11][C@@:12]1([H:33])[C@@:13]([O:14][H:34])([H:35])[C:15]([F:16])([H:36])[C@:17]([O:18][H:37])([H:38])[O:19][C@@:20]1([C:21]([O:22][H:39])([H:40])[H:41])[H:42]
Derived Operators
EVODEX.1-F305 - Elemental Balance
| P | 1 |
| O | 4 |
| H | 3 |
EVODEX.1-M26 - Mass Difference
97.97689
EVODEX.1-C374 - Reaction Operator C
[#8:11]-[#6@:10]-[#6@@:64]-[#6@:66]-[#6@@:68]>>[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6@@:10]-[#6@:64]-[#6@@:66]-[#6@:68].[H]-[#8:11]
EVODEX.1-N444 - Reaction Operator N
[#8:9]1-[#6@@:8]-[#6@:68](-[#6@@:66](-[#6@:64](-[#6@@:10]-1(-[#8:11]-[#6@:12])-[H:121])(-[#8:65])-[H:123])(-[#8:67])-[H:125])(-[#8:69])-[H:127]>>[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6@@:10]1(-[H:121])-[#8:9]-[#6@@:8]-[#6@:68](-[#8:69])(-[H:127])-[#6@@:66](-[#8:67])(-[H:125])-[#6@:64]-1(-[#8:65])-[H:123].[H]-[#8:11]-[#6@:12]
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-R3117
[H][O:3][P:2](=[O:1])([O:4][H:30])[O:5][H:31].[O:6]([C:7]([C@@:8]1([H:32])[O:9][C@:10]([O:11][C@@:12]2([H:33])[C@@:13]([O:14][H:34])([H:35])[C:15]([F:16])([H:36])[C@:17]([O:18][H:37])([H:38])[O:19][C@@:20]2([C:21]([O:22][H:39])([H:40])[H:41])[H:42])([H:43])[C@:23]([O:24][H:44])([H:45])[C@:25]([O:26][H:46])([H:47])[C@@:27]1([O:28][H:48])[H:49])([H:50])[H:51])[H:52]>>[O:1]=[P:2]([O:3][C@@:10]1([H:43])[O:9][C@@:8]([C:7]([O:6][H:52])([H:50])[H:51])([H:32])[C@:27]([O:28][H:48])([H:49])[C@@:25]([O:26][H:46])([H:47])[C@@:23]1([O:24][H:44])[H:45])([O:4][H:30])[O:5][H:31].[H][O:11][C@@:12]1([H:33])[C@@:13]([O:14][H:34])([H:35])[C:15]([F:16])([H:36])[C@:17]([O:18][H:37])([H:38])[O:19][C@@:20]1([C:21]([O:22][H:39])([H:40])[H:41])[H:42]