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EVODEX.1-P2882

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]N([H])[C@@:15]([H])([C:14]([C:12]([N:11]([H:26])[H:27])=[O:13])([H:24])[H:25])[C:17](=[O:18])[O:19][H:22].[H]OC(=O)C(C([H])([H])C([H])([H])C(=O)N([H])[H])=[O:7]>>[O:7]=[C:15]([C:14]([C:12]([N:11]([H:26])[H:27])=[O:13])([H:24])[H:25])[C:17](=[O:18])[O:19][H:22]

Derived Operators

EVODEX.1-F376 - Elemental Balance

O-3
C-5
N-2
H-10

EVODEX.1-M153 - Mass Difference

-146.06920000000002

EVODEX.1-E1169 - Reaction Operator E

Reaction Operator E SMIRKS

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

EVODEX.1-C442 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7](-[H])-[#6:12]-[H].[H]-[#8]-[#6](=[#8])-[#6](-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#7](-[H])-[H])=[#8:7]>>[#8:7]=[#6:12]

EVODEX.1-N535 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7](-[H])-[#6:12](-[H])(-[#6:13])-[#6:15].[H]-[#8]-[#6](=[#8])-[#6](-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#7](-[H])-[H])=[#8:7]>>[#8:7]=[#6:12](-[#6:13])-[#6:15]

EVODEX.1-Em14 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6](=[#8])-[#6](-[#6])=[#8:6].[H]-[#7](-[H])-[#6:11](-[H])(-[#6:12])-[#6:21]=[#8:22]>>[#8:6]=[#6:11](-[#6:12])-[#6:21]=[#8:22]

EVODEX.1-Cm16 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7]-[#6:39]-[H].[#6]=[#8:47]>>[#6:39]=[#8:47]

EVODEX.1-Nm12 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7](-[H])-[#6:39](-[H])(-[#6:5])-[#6:37].[#6]-[#6](-[#6])=[#8:47]>>[#6:5]-[#6:39](-[#6:37])=[#8:47]

Source Full Reactions

EVODEX.1-R3569

Full Reaction Rendering

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