SMIRKS
[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][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].[H][O:20][H]
Derived Operators
EVODEX.1-M3 - Mass Difference
2.01566
EVODEX.1-E12 - Reaction Operator E
[#6:18]-[#6:19](=[#8:20])-[H:31].[#7:23](-[H:42])(-[H:43])-[H]>>[#6:18]-[#6:19](-[#7:23](-[H:42])-[H:43])(-[H:31])-[H].[#8:20](-[H])-[H]
EVODEX.1-N248 - Reaction Operator N
[#6:18]-[#6:19](=[#8:20])-[H:33].[H]-[#7:23](-[H:42])-[H:43]>>[H]-[#6:19](-[#6:18])(-[#7:23](-[H:42])-[H:43])-[H:33].[H]-[#8:20]-[H]
EVODEX.1-Em370 - Reaction Operator Em
[#6:18]-[#6:19]=[#8:20].[H]-[#7:23]>>[H]-[#6:19](-[#6:18])-[#7:23].[H]-[#8:20]-[H]
EVODEX.1-Cm66 - Reaction Operator Cm
[H]-[#7:49].[#6:61]=[#8:62]>>[H]-[#6:61]-[#7:49].[H]-[#8:62]-[H]
EVODEX.1-Nm330 - Reaction Operator Nm
[#6:18]-[#6:19]=[#8:20].[H]-[#7:23]>>[H]-[#6:19](-[#6:18])-[#7:23].[H]-[#8:20]-[H]
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]