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EVODEX.1-P1391

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2](=[O:3])[H:14])([H:15])([H:16])[H:17].[H][O:13][C:11]([C:9]([C:8]([C:7]([C:5](=[O:4])[O:6][H:18])([H:22])[H:23])([H:20])[H:21])=[O:10])=[O:12]>>[C:11](=[O:12])=[O:13].[H][O:3][C:2]([C:1]([H:15])([H:16])[H:17])([C:9]([C:8]([C:7]([C:5](=[O:4])[O:6][H:18])([H:22])[H:23])([H:20])[H:21])=[O:10])[H:14]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E271 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:2]-[#6:3](=[#8:4])-[#6:5](=[#8:6])-[#8:7]-[H].[#6:14]-[#6:15](=[#8:16])-[H:27]>>[#6:5](=[#8:6])=[#8:7].[#6:2]-[#6:3](=[#8:4])-[#6:15](-[#6:14])(-[#8:16]-[H])-[H:27]

EVODEX.1-C265 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N292 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8:6]-[#6:4](-[#6:2](-[#6:1])=[#8:3])=[#8:5].[#8:7]=[#6:8](-[#6:9])-[H:34]>>[#6:4](=[#8:5])=[#8:6].[H]-[#8:7]-[#6:8](-[#6:2](-[#6:1])=[#8:3])(-[#6:9])-[H:34]

EVODEX.1-Em416 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#8:6]-[#6:4](-[#6:2](-[#6:1])=[#8:3])=[#8:5].[#8:7]=[#6:8]-[#6:9]>>[#6:4](=[#8:5])=[#8:6].[H]-[#8:7]-[#6:8](-[#6:2](-[#6:1])=[#8:3])-[#6:9]

EVODEX.1-Cm232 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm376 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#8:6]-[#6:4](-[#6:2](-[#6:1])=[#8:3])=[#8:5].[#8:7]=[#6:8]-[#6:9]>>[#6:4](=[#8:5])=[#8:6].[H]-[#8:7]-[#6:8](-[#6:2](-[#6:1])=[#8:3])-[#6:9]

Source Full Reactions

EVODEX.1-R1905

Full Reaction Rendering

[C:1]([C:2](=[O:3])[H:14])([H:15])([H:16])[H:17].[H][O:13][C:11]([C:9]([C:8]([C:7]([C:5](=[O:4])[O:6][H:18])([H:22])[H:23])([H:20])[H:21])=[O:10])=[O:12]>>[C:11](=[O:12])=[O:13].[H][O:3][C:2]([C:1]([H:15])([H:16])[H:17])([C:9]([C:8]([C:7]([C:5](=[O:4])[O:6][H:18])([H:22])[H:23])([H:20])[H:21])=[O:10])[H:14]