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EVODEX.1-P2985

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

O=[C:10]([C:9]1:[C:6]([C:7]([O:8][H:28])([H:29])[H:30]):[C:5]([H:27]):[N:4]:[C:3]([C:2]([C:1]([H:35])([H:36])[H:37])([H:33])[H:34]):[C:12]:1[O:13][H:32])[H:31]>>[H]N([H])[C:10]([H])([C:9]1:[C:6]([C:7]([O:8][H:28])([H:29])[H:30]):[C:5]([H:27]):[N:4]:[C:3]([C:2]([C:1]([H:35])([H:36])[H:37])([H:33])[H:34]):[C:12]:1[O:13][H:32])[H:31]

Derived Operators

EVODEX.1-F170 - Elemental Balance

O-1
N1
H3

EVODEX.1-M69 - Mass Difference

1.0316900000000002

EVODEX.1-E839 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:5]-[#6:6](=[#8])-[H:15]>>[#6:5]-[#6:6](-[#7](-[H])-[H])(-[H:15])-[H]

EVODEX.1-C59 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N245 - Reaction Operator N

Reaction Operator N SMIRKS

[#8]=[#6:10](-[#6:9])-[H:31]>>[H]-[#7](-[H])-[#6:10](-[H])(-[#6:9])-[H:31]

EVODEX.1-Em367 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8]=[#6:10]-[#6:9]>>[H]-[#7](-[H])-[#6:10](-[H])-[#6:9]

EVODEX.1-Cm96 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm327 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#8]=[#6:10]-[#6:9]>>[H]-[#7](-[H])-[#6:10](-[H])-[#6:9]

Source Full Reactions

EVODEX.1-R3651

Full Reaction Rendering

[H][C@@:15]([C:14]([H:24])([H:25])[H:26])([N:16]([H:20])[H:21])[C:17](=[O:18])[O:19][H:22].[C:1]([C:2]([C:3]1:[N:4]:[C:5]([H:27]):[C:6]([C:7]([O:8][H:28])([H:29])[H:30]):[C:9]([C:10](=[O:11])[H:31]):[C:12]:1[O:13][H:32])([H:33])[H:34])([H:35])([H:36])[H:37]>>[H][C:10]([C:9]1:[C:6]([C:7]([O:8][H:28])([H:29])[H:30]):[C:5]([H:27]):[N:4]:[C:3]([C:2]([C:1]([H:35])([H:36])[H:37])([H:33])[H:34]):[C:12]:1[O:13][H:32])([N:16]([H:20])[H:21])[H:31].[O:11]=[C:15]([C:14]([H:24])([H:25])[H:26])[C:17](=[O:18])[O:19][H:22]