SMIRKS
O=[C:19]([C:18]([C:17]([C:15]([O:14][C:13]1:[C:5]([C:6]([C:7]([O:8][P:9](=[O:10])([O:11][H:27])[O:12][H:28])([H:29])[H:30])([H:31])[H:32]):[C:4]([H:26]):[N:3]:[C:2]([C:1]([H:39])([H:40])[H:41]):[C:21]:1[O:22][H:38])=[O:16])([H:36])[H:37])([H:34])[H:35])[H:33].[H][N:23]([H:42])[H:43]>>[H][C:19]([C:18]([C:17]([C:15]([O:14][C:13]1:[C:5]([C:6]([C:7]([O:8][P:9](=[O:10])([O:11][H:27])[O:12][H:28])([H:29])[H:30])([H:31])[H:32]):[C:4]([H:26]):[N:3]:[C:2]([C:1]([H:39])([H:40])[H:41]):[C:21]:1[O:22][H:38])=[O:16])([H:36])[H:37])([H:34])[H:35])([N:23]([H:42])[H:43])[H:33]
Derived Operators
EVODEX.1-M9 - Mass Difference
-15.9949
EVODEX.1-E435 - Reaction Operator E
[#6:18]-[#6:19](=[#8])-[H:31].[#7:23](-[H:42])(-[H:43])-[H]>>[#6:18]-[#6:19](-[#7:23](-[H:42])-[H:43])(-[H:31])-[H]
EVODEX.1-N250 - Reaction Operator N
[#8]=[#6:19](-[#6:18])-[H:31].[H]-[#7:23](-[H:42])-[H:43]>>[H]-[#6:19](-[#6:18])(-[#7:23](-[H:42])-[H:43])-[H:31]
EVODEX.1-Em372 - Reaction Operator Em
[#8]=[#6:19]-[#6:18].[H]-[#7:23]>>[H]-[#6:19](-[#6:18])-[#7:23]
EVODEX.1-Nm332 - Reaction Operator Nm
[#8]=[#6:19]-[#6:18].[H]-[#7:23]>>[H]-[#6:19](-[#6:18])-[#7:23]
Source Full Reactions
EVODEX.1-R1036
[C:1]([C:2]1:[N:3]:[C:4]([H:26]):[C:5]([C:6]([C:7]([O:8][P:9](=[O:10])([O:11][H:27])[O:12][H:28])([H:29])[H:30])([H:31])[H:32]):[C:13]([O:14][C:15](=[O:16])[C:17]([C:18]([C:19](=[O:20])[H:33])([H:34])[H:35])([H:36])[H:37]):[C:21]:1[O:22][H:38])([H:39])([H:40])[H:41].[H][N:23]([H:42])[H:43].[H][O:24][O:25][H]>>[H][C:19]([C:18]([C:17]([C:15]([O:14][C:13]1:[C:5]([C:6]([C:7]([O:8][P:9](=[O:10])([O:11][H:27])[O:12][H:28])([H:29])[H:30])([H:31])[H:32]):[C:4]([H:26]):[N:3]:[C:2]([C:1]([H:39])([H:40])[H:41]):[C:21]:1[O:22][H:38])=[O:16])([H:36])[H:37])([H:34])[H:35])([N:23]([H:42])[H:43])[H:33].[O:24]=[O:25].[H][O:20][H]