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EVODEX.1-P2855

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]N([H])[C:2]([H])([C:3]([C:4]([C@:5]([N:6]([H:21])[H:22])([C:7]([C:8](=[O:9])[O:10][H:23])([H:24])[H:25])[H:26])([H:27])[H:28])([H:29])[H:30])[H:31]>>O=[C:2]([C:3]([C:4]([C@:5]([N:6]([H:21])[H:22])([C:7]([C:8](=[O:9])[O:10][H:23])([H:24])[H:25])[H:26])([H:27])[H:28])([H:29])[H:30])[H:31]

Derived Operators

EVODEX.1-F72 - Elemental Balance

O1
N-1
H-3

EVODEX.1-M60 - Mass Difference

-1.0316900000000002

EVODEX.1-E620 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:20](-[#6@@:19])(-[#7](-[H])-[H])(-[H:63])-[H]>>[#6:20](-[#6@@:19])(=[#8])-[H:63]

EVODEX.1-C60 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7](-[H])-[#6@@:8]-[H]>>[#8]=[#6:8]

EVODEX.1-N242 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7](-[H])-[#6:8](-[H])(-[#6:9])-[H:22]>>[#8]=[#6:8](-[#6:9])-[H:22]

EVODEX.1-Em364 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7](-[H])-[#6:8](-[H])-[#6:9]>>[#8]=[#6:8]-[#6:9]

EVODEX.1-Cm97 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7]-[#6:8]-[H]>>[#8]=[#6:8]

EVODEX.1-Nm324 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7](-[H])-[#6:8](-[H])-[#6:9]>>[#8]=[#6:8]-[#6:9]

Source Full Reactions

EVODEX.1-R3547

Full Reaction Rendering

[H][C:2]([N:1]([H:33])[H:34])([C:3]([C:4]([C@:5]([N:6]([H:21])[H:22])([C:7]([C:8](=[O:9])[O:10][H:23])([H:24])[H:25])[H:26])([H:27])[H:28])([H:29])[H:30])[H:31].[O:11]=[C:12]([O:13][H:35])[C:14]([C:15]([C:16](=[O:17])[C:18](=[O:19])[O:20][H:36])([H:37])[H:38])([H:39])[H:40]>>[C:2]([C:3]([C:4]([C@:5]([N:6]([H:21])[H:22])([C:7]([C:8](=[O:9])[O:10][H:23])([H:24])[H:25])[H:26])([H:27])[H:28])([H:29])[H:30])(=[O:17])[H:31].[H][C:16]([N:1]([H:33])[H:34])([C:15]([C:14]([C:12](=[O:11])[O:13][H:35])([H:39])[H:40])([H:37])[H:38])[C:18](=[O:19])[O:20][H:36]