SMIRKS
[H][C:2]([N:1]([H:34])[H:35])([C:3]([C:4]([C:5]([C:6]([C:7](=[O:8])[O:9][H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])[H:31])[C:10](=[O:11])[O:12][H:32]>>O=[C:2]([C:3]([C:4]([C:5]([C:6]([C:7](=[O:8])[O:9][H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])[H:31])[C:10](=[O:11])[O:12][H:32].[H]OC(=O)C([H])([H])C([H])([H])[C@@]([H])(C(=O)O[H])[N:1]([H:34])[H:35]
Derived Operators
EVODEX.1-F60 - Elemental Balance
| O | 5 |
| C | 5 |
| H | 6 |
EVODEX.1-M58 - Mass Difference
146.02147999999997
EVODEX.1-C65 - Reaction Operator C
[H]-[#6@@:39]-[#7:40]>>[#8]=[#6:39].[H]-[#8]-[#6](=[#8])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#8]-[H])-[#7:40]
EVODEX.1-N51 - Reaction Operator N
[H]-[#6@@:39](-[#7:40](-[H:70])-[H:71])(-[#6@:5])-[#6@:37]>>[#8]=[#6:39](-[#6@:5])-[#6@:37].[H]-[#8]-[#6](=[#8])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#8]-[H])-[#7:40](-[H:70])-[H:71]
EVODEX.1-Em17 - Reaction Operator Em
[H]-[#6:2](-[#7:1])(-[#6:3])-[#6:14]=[#8:15]>>[#8]=[#6:2](-[#6:3])-[#6:14]=[#8:15].[#6]-[#6](-[H])(-[#6])-[#7:1]
EVODEX.1-Nm13 - Reaction Operator Nm
[H]-[#6:39](-[#7:40])(-[#6:5])-[#6:37]>>[#8]=[#6:39](-[#6:5])-[#6:37].[#6]-[#6](-[H])(-[#6])-[#7:40]
Source Full Reactions
EVODEX.1-R3749
[H][C:2]([N:1]([H:34])[H:35])([C:3]([C:4]([C:5]([C:6]([C:7](=[O:8])[O:9][H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])[H:31])[C:10](=[O:11])[O:12][H:32].[O:13]=[C:14]([O:15][H:36])[C:16]([C:17]([C:18](=[O:19])[C:20](=[O:21])[O:22][H:37])([H:38])[H:39])([H:40])[H:41]>>[C:2]([C:3]([C:4]([C:5]([C:6]([C:7](=[O:8])[O:9][H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])[H:31])([C:10](=[O:11])[O:12][H:32])=[O:19].[H][C@:18]([N:1]([H:34])[H:35])([C:17]([C:16]([C:14](=[O:13])[O:15][H:36])([H:40])[H:41])([H:38])[H:39])[C:20](=[O:21])[O:22][H:37]