SMIRKS
[O:6]([C:7]([C@@:8]1([H:43])[O:9][C@:10]([O:11][C@@:12]2([H:44])[C@@:13]([O:14][H:45])([H:46])[C@:15]([O:16][H:47])([H:48])[C@:17]([O:18][C@@:19]3([H:49])[C@@:20]([O:21][H:50])([H:51])[C@:22]([O:23][H:52])([H:53])[C@@:24]([O:25][H:54])([H:55])[O:26][C@@:27]3([C:28]([O:29][H:56])([H:57])[H:58])[H:59])([H:60])[O:30][C@@:31]2([C:32]([O:33][H:61])([H:62])[H:63])[H:64])([H:65])[C@@:34]([O:35][H:66])([H:67])[C@:36]([O:37][H:68])([H:69])[C@@:38]1([O:39][H:70])[H:71])([H:72])[H:73])[H:74]>>[H]OP(=O)(O[H])O[C@@:10]1([H:65])[O:9][C@@:8]([C:7]([O:6][H:74])([H:72])[H:73])([H:43])[C@:38]([O:39][H:70])([H:71])[C@@:36]([O:37][H:68])([H:69])[C@:34]1([O:35][H:66])[H:67].[H][O:11][C@@:12]1([H:44])[C@@:13]([O:14][H:45])([H:46])[C@:15]([O:16][H:47])([H:48])[C@:17]([O:18][C@@:19]2([H:49])[C@@:20]([O:21][H:50])([H:51])[C@:22]([O:23][H:52])([H:53])[C@@:24]([O:25][H:54])([H:55])[O:26][C@@:27]2([C:28]([O:29][H:56])([H:57])[H:58])[H:59])([H:60])[O:30][C@@:31]1([C:32]([O:33][H:61])([H:62])[H:63])[H:64]
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-R2960
[H][O:3][P:2](=[O:1])([O:4][H:41])[O:5][H:42].[O:6]([C:7]([C@@:8]1([H:43])[O:9][C@:10]([O:11][C@@:12]2([H:44])[C@@:13]([O:14][H:45])([H:46])[C@:15]([O:16][H:47])([H:48])[C@:17]([O:18][C@@:19]3([H:49])[C@@:20]([O:21][H:50])([H:51])[C@:22]([O:23][H:52])([H:53])[C@@:24]([O:25][H:54])([H:55])[O:26][C@@:27]3([C:28]([O:29][H:56])([H:57])[H:58])[H:59])([H:60])[O:30][C@@:31]2([C:32]([O:33][H:61])([H:62])[H:63])[H:64])([H:65])[C@@:34]([O:35][H:66])([H:67])[C@:36]([O:37][H:68])([H:69])[C@@:38]1([O:39][H:70])[H:71])([H:72])[H:73])[H:74]>>[O:1]=[P:2]([O:3][C@@:10]1([H:65])[O:9][C@@:8]([C:7]([O:6][H:74])([H:72])[H:73])([H:43])[C@:38]([O:39][H:70])([H:71])[C@@:36]([O:37][H:68])([H:69])[C@:34]1([O:35][H:66])[H:67])([O:4][H:41])[O:5][H:42].[H][O:11][C@@:12]1([H:44])[C@@:13]([O:14][H:45])([H:46])[C@:15]([O:16][H:47])([H:48])[C@:17]([O:18][C@@:19]2([H:49])[C@@:20]([O:21][H:50])([H:51])[C@:22]([O:23][H:52])([H:53])[C@@:24]([O:25][H:54])([H:55])[O:26][C@@:27]2([C:28]([O:29][H:56])([H:57])[H:58])[H:59])([H:60])[O:30][C@@:31]1([C:32]([O:33][H:61])([H:62])[H:63])[H:64]