SMIRKS
[C:1]([C@:2]([O:3][H:16])([C:4](=[O:5])[H:17])[H:18])([H:19])([H:20])[H:21]>>[H]O[C@@]([H])(C(=O)C([H])([H])OP(=O)(O[H])O[H])[C@@:4]([C@:2]([C:1]([H:19])([H:20])[H:21])([O:3][H:16])[H:18])([O:5][H])[H:17]
Derived Operators
EVODEX.1-F236 - Elemental Balance
| P | 1 |
| O | 6 |
| C | 3 |
| H | 7 |
EVODEX.1-M136 - Mass Difference
169.99801
EVODEX.1-E958 - Reaction Operator E
[#6:3]-[#6:4](=[#8:5])-[H:19]>>[#6:3]-[#6:4](-[#8:5]-[H])(-[#6](-[#6](=[#8])-[#6](-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[H])(-[H])-[H])(-[#8]-[H])-[H])-[H:19]
EVODEX.1-C726 - Reaction Operator C
[#8:11]=[#6:12]>>[H]-[#8]-[#6](-[H])(-[#6](=[#8])-[#6](-[H])(-[H])-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[H])-[#6:12]-[#8:11]-[H]
EVODEX.1-N927 - Reaction Operator N
[#8:11]=[#6:12](-[#6:13])-[H:32]>>[H]-[#8]-[#6](-[H])(-[#6](=[#8])-[#6](-[H])(-[H])-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[H])-[#6:12](-[#8:11]-[H])(-[#6:13])-[H:32]
EVODEX.1-Em72 - Reaction Operator Em
[#8:7]=[#6:8]-[#6:9]>>[#6]-[#6](-[H])(-[#8])-[#6:8](-[#8:7]-[H])-[#6:9]
EVODEX.1-Nm86 - Reaction Operator Nm
[#8:7]=[#6:8]-[#6:9]>>[#6]-[#6](-[H])(-[#8])-[#6:8](-[#8:7]-[H])-[#6:9]
Source Full Reactions
EVODEX.1-R6852
[C:1]([C@:2]([O:3][H:16])([C:4](=[O:5])[H:17])[H:18])([H:19])([H:20])[H:21].[H][C:8]([C:7](=[O:6])[C:10]([O:11][P:12](=[O:13])([O:14][H:25])[O:15][H:26])([H:27])[H:28])([O:9][H:22])[H:23]>>[H][O:5][C@:4]([C@:2]([C:1]([H:19])([H:20])[H:21])([O:3][H:16])[H:18])([C@:8]([C:7](=[O:6])[C:10]([O:11][P:12](=[O:13])([O:14][H:25])[O:15][H:26])([H:27])[H:28])([O:9][H:22])[H:23])[H:17]