EVODEX.1-P5766

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([O:2][C:3]1:[C:4]([H:24]):[C:5]([C:6](=[C:7]([C:8](=[O:9])[N:10]([C:11]([C:12]([C:13](=[O:14])[O:15][H:25])([H:26])[H:27])([C:16](=[O:17])[O:18][H:28])[H:29])[H:30])[H:31])[H:32]):[C:19]([H:33]):[C:20]([H:34]):[C:21]:1[O:22][H:35])([H:36])([H:37])[H:38].[H][O:23][H:39]>>[C:1]([O:2][C:3]1:[C:4]([H:24]):[C:5]([C:6](=[C:7]([C:8](=[O:9])[O:23][H:39])[H:31])[H:32]):[C:19]([H:33]):[C:20]([H:34]):[C:21]:1[O:22][H:35])([H:36])([H:37])[H:38].[H][N:10]([C:11]([C:12]([C:13](=[O:14])[O:15][H:25])([H:26])[H:27])([C:16](=[O:17])[O:18][H:28])[H:29])[H:30]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-C12 - Reaction Operator C

Reaction Operator C SMIRKS

[#7:23]-[#6:24].[H]-[#8:1]>>[H]-[#7:23].[#8:1]-[#6:24]

EVODEX.1-N93 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:7]-[#6:8](=[#8:9])-[#7:10](-[#6:11])-[H:30].[H]-[#8:23]-[H:39]>>[#6:7]-[#6:8](=[#8:9])-[#8:23]-[H:39].[H]-[#7:10](-[#6:11])-[H:30]

EVODEX.1-Em648 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:6]=[#6:7]-[#6:8](=[#8:9])-[#7:10]-[#6:11].[H]-[#8:23]>>[#6:6]=[#6:7]-[#6:8](=[#8:9])-[#8:23].[H]-[#7:10]-[#6:11]

EVODEX.1-Cm24 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7:23]-[#6:24].[H]-[#8:1]>>[H]-[#7:23].[#8:1]-[#6:24]

EVODEX.1-Nm49 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:7]-[#6:8](=[#8:9])-[#7:10]-[#6:11].[H]-[#8:23]>>[#6:7]-[#6:8](=[#8:9])-[#8:23].[H]-[#7:10]-[#6:11]

Source Full Reactions

EVODEX.1-R6462

Full Reaction Rendering

[C:1]([O:2][C:3]1:[C:4]([H:24]):[C:5]([C:6](=[C:7]([C:8](=[O:9])[N:10]([C:11]([C:12]([C:13](=[O:14])[O:15][H:25])([H:26])[H:27])([C:16](=[O:17])[O:18][H:28])[H:29])[H:30])[H:31])[H:32]):[C:19]([H:33]):[C:20]([H:34]):[C:21]:1[O:22][H:35])([H:36])([H:37])[H:38].[H][O:23][H:39]>>[C:1]([O:2][C:3]1:[C:4]([H:24]):[C:5]([C:6](=[C:7]([C:8](=[O:9])[O:23][H:39])[H:31])[H:32]):[C:19]([H:33]):[C:20]([H:34]):[C:21]:1[O:22][H:35])([H:36])([H:37])[H:38].[H][N:10]([C:11]([C:12]([C:13](=[O:14])[O:15][H:25])([H:26])[H:27])([C:16](=[O:17])[O:18][H:28])[H:29])[H:30]