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EVODEX.1-P1098

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:19]([C:18]([C:17]([C:15]([O:14][C:13]([C:12]1:[C:5]([C:6]([O:7][P:8](=[O:9])([O:10][H:27])[O:11][H:28])([H:29])[H:30]):[C:4]([H:26]):[N:3]:[C:2]([C:1]([H:42])([H:43])[H:44]):[C:21]:1[O:22][H:41])([H:39])[H:40])=[O:16])([H:37])[H:38])([H:35])[H:36])([N:20]([H:31])[H:32])[H:33]>>O=[C:19]([C:18]([C:17]([C:15]([O:14][C:13]([C:12]1:[C:5]([C:6]([O:7][P:8](=[O:9])([O:10][H:27])[O:11][H:28])([H:29])[H:30]):[C:4]([H:26]):[N:3]:[C:2]([C:1]([H:42])([H:43])[H:44]):[C:21]:1[O:22][H:41])([H:39])[H:40])=[O:16])([H:37])[H:38])([H:35])[H:36])[H:33].[H][N:20]([H:31])[H:32]

Derived Operators

EVODEX.1-F10 - Elemental Balance

O1

EVODEX.1-M6 - Mass Difference

15.9949

EVODEX.1-E407 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:2]-[#6:4](-[#7:5](-[H:10])-[H:11])(-[H:12])-[H]>>[#6:2]-[#6:4](=[#8])-[H:12].[#7:5](-[H:10])(-[H:11])-[H]

EVODEX.1-C18 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:1]-[#7:2]>>[#8]=[#6:1].[H]-[#7:2]

EVODEX.1-N232 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:4](-[#6:2])(-[#7:5](-[H:10])-[H:11])-[H:12]>>[#8]=[#6:4](-[#6:2])-[H:12].[H]-[#7:5](-[H:10])-[H:11]

EVODEX.1-Em347 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:4](-[#6:2])-[#7:5]>>[#8]=[#6:4]-[#6:2].[H]-[#7:5]

EVODEX.1-Cm55 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:1]-[#7:2]>>[#8]=[#6:1].[H]-[#7:2]

EVODEX.1-Nm314 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6:4](-[#6:2])-[#7:5]>>[#8]=[#6:4]-[#6:2].[H]-[#7:5]

Source Full Reactions

EVODEX.1-R1035

Full Reaction Rendering

[H][C:19]([C:18]([C:17]([C:15]([O:14][C:13]([C:12]1:[C:5]([C:6]([O:7][P:8](=[O:9])([O:10][H:27])[O:11][H:28])([H:29])[H:30]):[C:4]([H:26]):[N:3]:[C:2]([C:1]([H:42])([H:43])[H:44]):[C:21]:1[O:22][H:41])([H:39])[H:40])=[O:16])([H:37])[H:38])([H:35])[H:36])([N:20]([H:31])[H:32])[H:33].[O:24]=[O:25].[H][O:23][H]>>[C:1]([C:2]1:[N:3]:[C:4]([H:26]):[C:5]([C:6]([O:7][P:8](=[O:9])([O:10][H:27])[O:11][H:28])([H:29])[H:30]):[C:12]([C:13]([O:14][C:15](=[O:16])[C:17]([C:18]([C:19](=[O:23])[H:33])([H:35])[H:36])([H:37])[H:38])([H:39])[H:40]):[C:21]:1[O:22][H:41])([H:42])([H:43])[H:44].[H][N:20]([H:31])[H:32].[H][O:24][O:25][H]