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EVODEX.1-P2925

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:1]([C:2]([C@@:3]([N:4]([H:18])[H:19])([C:5](=[O:6])[O:7][H:20])[H:21])([H:22])[H:23])([H:24])[H:25]>>[H]OC(=O)[C:1]([C:2]([C@@:3]([N:4]([H:18])[H:19])([C:5](=[O:6])[O:7][H:20])[H:21])([H:22])[H:23])([H:24])[H:25]

Derived Operators

EVODEX.1-F57 - Elemental Balance

O2
C1

EVODEX.1-M101 - Mass Difference

43.9898

EVODEX.1-E590 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:7]-[#6:8](-[H:98])(-[H:99])-[H]>>[#6:7]-[#6:8](-[#6](=[#8])-[#8]-[H])(-[H:98])-[H:99]

EVODEX.1-C89 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N111 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:8](-[#6:7])(-[H:98])-[H:99]>>[H]-[#8]-[#6](=[#8])-[#6:8](-[#6:7])(-[H:98])-[H:99]

EVODEX.1-Em174 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm51 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm187 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R3603

Full Reaction Rendering

[H][C:1]([C:2]([C@@:3]([N:4]([H:18])[H:19])([C:5](=[O:6])[O:7][H:20])[H:21])([H:22])[H:23])([H:24])[H:25].[O:8]=[C:9]([O:10][H:27])[C:11]([C:12]([C:13](=[O:14])[C:15](=[O:16])[O:17][H:28])([H:29])[H:30])([H:31])[H:32]>>[C:1]([C:2]([C@@:3]([N:4]([H:18])[H:19])([C:5](=[O:6])[O:7][H:20])[H:21])([H:22])[H:23])([C:9](=[O:8])[O:10][H:27])([H:24])[H:25].[H][C:11]([C:12]([C:13](=[O:14])[C:15](=[O:16])[O:17][H:28])([H:29])[H:30])([H:31])[H:32]

EVODEX.1-R3604

Full Reaction Rendering

[H][C:1]([C:2]([C@@:3]([N:4]([H:18])[H:19])([C:5](=[O:6])[O:7][H:20])[H:21])([H:22])[H:23])([H:24])[H:25].[O:8]=[C:9]([O:10][H:27])[C:11]([C:12]([C:13](=[O:14])[C:15](=[O:16])[O:17][H:28])([H:29])[H:30])([H:31])[H:32]>>[C:1]([C:2]([C@@:3]([N:4]([H:18])[H:19])([C:5](=[O:6])[O:7][H:20])[H:21])([H:22])[H:23])([C:15](=[O:16])[O:17][H:28])([H:24])[H:25].[H][C:13]([C:12]([C:11]([C:9](=[O:8])[O:10][H:27])([H:31])[H:32])([H:29])[H:30])=[O:14]

EVODEX.1-R3695

Full Reaction Rendering

[H][C:1]([C:2]([C@:3]([N:4]([H:18])[H:19])([C:5](=[O:6])[O:7][H:20])[H:21])([H:22])[H:23])([H:24])[H:25].[N:8]([C:9]([C:10]([C:11]([C:12](=[O:13])[O:14][H:27])([H:28])[H:29])([H:30])[H:31])([C:15](=[O:16])[O:17][H:32])[H:33])([H:34])[H:35]>>[C:1]([C:2]([C@:3]([N:4]([H:18])[H:19])([C:5](=[O:6])[O:7][H:20])[H:21])([H:22])[H:23])([C:12](=[O:13])[O:14][H:27])([H:24])[H:25].[H][C:11]([C:10]([C:9]([N:8]([H:34])[H:35])([C:15](=[O:16])[O:17][H:32])[H:33])([H:30])[H:31])([H:28])[H:29]