EVODEX.1-P6359

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][O:8][C:7]([C:6]([C:4]([C:2](=[O:1])[O:3][H:24])=[O:5])([H:41])[H:42])([C:9]1([H:26])[C:10]([H:27])([H:28])[C:11]([H:29])([H:30])[C:12]([H:31])([H:32])[N:13]1[C:14](=[O:15])[O:16][C:17]([C:18]1:[C:19]([H:33]):[C:20]([H:34]):[C:21]([H:35]):[C:22]([H:36]):[C:23]:1[H:37])([H:38])[H:39])[H:40]>>[C:7](=[O:8])([C:9]1([H:26])[C:10]([H:27])([H:28])[C:11]([H:29])([H:30])[C:12]([H:31])([H:32])[N:13]1[C:14](=[O:15])[O:16][C:17]([C:18]1:[C:19]([H:33]):[C:20]([H:34]):[C:21]([H:35]):[C:22]([H:36]):[C:23]:1[H:37])([H:38])[H:39])[H:40].[H][C:6]([C:4]([C:2](=[O:1])[O:3][H:24])=[O:5])([H:41])[H:42]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E106 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:2]-[#6:4](-[#8:5]-[H])(-[#6:6](-[#6:7])(-[H:17])-[H:18])-[H:19]>>[#6:2]-[#6:4](=[#8:5])-[H:19].[#6:6](-[#6:7])(-[H:17])(-[H:18])-[H]

EVODEX.1-C3 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#8:5]-[#6:4]-[#6:6]>>[#6:4]=[#8:5].[H]-[#6:6]

EVODEX.1-N930 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8:5]-[#6:4](-[#6:2])(-[#6:6](-[#6:7])(-[H:17])-[H:18])-[H:19]>>[#6:2]-[#6:4](=[#8:5])-[H:19].[H]-[#6:6](-[#6:7])(-[H:17])-[H:18]

EVODEX.1-Em738 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm26 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#8:5]-[#6:4]-[#6:6]>>[#6:4]=[#8:5].[H]-[#6:6]

EVODEX.1-Nm667 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R6958

Full Reaction Rendering

[H][O:8][C:7]([C:6]([C:4]([C:2](=[O:1])[O:3][H:24])=[O:5])([H:41])[H:42])([C:9]1([H:26])[C:10]([H:27])([H:28])[C:11]([H:29])([H:30])[C:12]([H:31])([H:32])[N:13]1[C:14](=[O:15])[O:16][C:17]([C:18]1:[C:19]([H:33]):[C:20]([H:34]):[C:21]([H:35]):[C:22]([H:36]):[C:23]:1[H:37])([H:38])[H:39])[H:40]>>[C:7](=[O:8])([C:9]1([H:26])[C:10]([H:27])([H:28])[C:11]([H:29])([H:30])[C:12]([H:31])([H:32])[N:13]1[C:14](=[O:15])[O:16][C:17]([C:18]1:[C:19]([H:33]):[C:20]([H:34]):[C:21]([H:35]):[C:22]([H:36]):[C:23]:1[H:37])([H:38])[H:39])[H:40].[H][C:6]([C:4]([C:2](=[O:1])[O:3][H:24])=[O:5])([H:41])[H:42]