SMIRKS
[H]C([H])([H])C([H])([H])[O:6][P:4]([O:3][C:2]([C:1]([H:45])([H:46])[H:47])([H:43])[H:44])(=[O:5])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:25])([H:26])[H:27])([C:15]([H:28])([H:29])[H:30])[H:31])[C:16]([C:17]([H:32])([H:33])[H:34])([C:18]([H:35])([H:36])[H:37])[H:38])([H:39])[H:40])([H:41])[H:42]>>[H][O:6][P:4]([O:3][C:2]([C:1]([H:45])([H:46])[H:47])([H:43])[H:44])(=[O:5])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:25])([H:26])[H:27])([C:15]([H:28])([H:29])[H:30])[H:31])[C:16]([C:17]([H:32])([H:33])[H:34])([C:18]([H:35])([H:36])[H:37])[H:38])([H:39])[H:40])([H:41])[H:42]
Derived Operators
EVODEX.1-F95 - Elemental Balance
| C | -2 |
| H | -4 |
EVODEX.1-M108 - Mass Difference
-28.03132
EVODEX.1-E680 - Reaction Operator E
[#15:4]-[#8:6]-[#6](-[#6](-[H])(-[H])-[H])(-[H])-[H]>>[#15:4]-[#8:6]-[H]
EVODEX.1-N658 - Reaction Operator N
[H]-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#8:6]-[#15:4]>>[H]-[#8:6]-[#15:4]
Source Full Reactions
EVODEX.1-R5141
[C:1]([C:2]([O:3][P:4](=[O:5])([O:6][C:7]([C:8]([H:20])([H:21])[H:22])([H:23])[H:24])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:25])([H:26])[H:27])([C:15]([H:28])([H:29])[H:30])[H:31])[C:16]([C:17]([H:32])([H:33])[H:34])([C:18]([H:35])([H:36])[H:37])[H:38])([H:39])[H:40])([H:41])[H:42])([H:43])[H:44])([H:45])([H:46])[H:47].[H][O:19][H:48]>>[C:7]([C:8]([H:20])([H:21])[H:22])([O:19][H:48])([H:23])[H:24].[H][O:6][P:4]([O:3][C:2]([C:1]([H:45])([H:46])[H:47])([H:43])[H:44])(=[O:5])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:25])([H:26])[H:27])([C:15]([H:28])([H:29])[H:30])[H:31])[C:16]([C:17]([H:32])([H:33])[H:34])([C:18]([H:35])([H:36])[H:37])[H:38])([H:39])[H:40])([H:41])[H:42]