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EVODEX.1-P300

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]OC(=O)[C:2]([H])([N:1]([H:23])[H:24])[C:3]([C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([H:17]):[N:8]:[C:9]:1[H:18])([H:19])[H:20]>>O=[C:2]([N:1]([H:23])[H:24])[C:3]([C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([H:17]):[N:8]:[C:9]:1[H:18])([H:19])[H:20]

Derived Operators

EVODEX.1-F63 - Elemental Balance

O-1
C-1
H-2

EVODEX.1-M103 - Mass Difference

-30.01056

EVODEX.1-E600 - Reaction Operator E

Reaction Operator E SMIRKS

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

EVODEX.1-C208 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#8]-[#6](=[#8])-[#6:3]-[H]>>[#8]=[#6:3]

EVODEX.1-N145 - Reaction Operator N

Reaction Operator N SMIRKS

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

EVODEX.1-Em228 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm186 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6]-[#6:3]-[H]>>[#8]=[#6:3]

EVODEX.1-Nm227 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R323

Full Reaction Rendering

[H][C:2]([N:1]([H:23])[H:24])([C:3]([C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([H:17]):[N:8]:[C:9]:1[H:18])([H:19])[H:20])[C:10](=[O:11])[O:12][H].[O:13]=[O:14]>>[C:10](=[O:11])=[O:12].[N:1]([C:2]([C:3]([C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([H:17]):[N:8]:[C:9]:1[H:18])([H:19])[H:20])=[O:13])([H:23])[H:24].[H][O:14][H]