SMIRKS
[H]OP(=O)(O[H])O[C:8]([C@:6]([C@@:3]([O:2][C:1]([H:25])([H:26])[H:27])([C:4]([O:5][H:15])([H:16])[H:17])[H:24])([O:7][H:18])[H:23])([H:21])[H:22].[H][O:14][H:28]>>[C:1]([O:2][C@@:3]([C:4]([O:5][H:15])([H:16])[H:17])([C@:6]([O:7][H:18])([C:8]([O:14][H:28])([H:21])[H:22])[H:23])[H:24])([H:25])([H:26])[H:27]
Derived Operators
EVODEX.1-F175 - Elemental Balance
| P | -1 |
| O | -4 |
| H | -3 |
EVODEX.1-M10 - Mass Difference
-97.97689
EVODEX.1-E851 - Reaction Operator E
[#6:4]-[#6:5](-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[H])(-[H:19])-[H:20].[#8:15](-[H:29])-[H]>>[#6:4]-[#6:5](-[#8:15]-[H:29])(-[H:19])-[H:20]
EVODEX.1-C76 - Reaction Operator C
[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6:6].[H]-[#8:1]>>[#8:1]-[#6:6]
EVODEX.1-N1122 - Reaction Operator N
[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6:6](-[#6:5])(-[H:20])-[H:21].[H]-[#8:1]-[H:25]>>[#8:1](-[#6:6](-[#6:5])(-[H:20])-[H:21])-[H:25]
EVODEX.1-Em104 - Reaction Operator Em
[#15]-[#8]-[#6:12]-[#6:11].[H]-[#8:37]>>[#6:11]-[#6:12]-[#8:37]
EVODEX.1-Nm137 - Reaction Operator Nm
[#15]-[#8]-[#6:12]-[#6:11].[H]-[#8:37]>>[#6:11]-[#6:12]-[#8:37]
Source Full Reactions
EVODEX.1-R5047
[C:1]([O:2][C@@:3]([C:4]([O:5][H:15])([H:16])[H:17])([C@:6]([O:7][H:18])([C:8]([O:9][P:10](=[O:11])([O:12][H:19])[O:13][H:20])([H:21])[H:22])[H:23])[H:24])([H:25])([H:26])[H:27].[H][O:14][H:28]>>[C:1]([O:2][C@@:3]([C:4]([O:5][H:15])([H:16])[H:17])([C@:6]([O:7][H:18])([C:8]([O:14][H:28])([H:21])[H:22])[H:23])[H:24])([H:25])([H:26])[H:27].[H][O:9][P:10](=[O:11])([O:12][H:19])[O:13][H:20]