EVODEX.1-P4670 - Partial Reaction

SMIRKS

[H]N([H])C(=O)C([H])([H])C([H])([H])[C@@]([H])(C(=O)[N:10]([C:11]1:[C:12]([H:24]):[C:13]([H:25]):[C:14]2:[C:15]([H:26]):[C:16]([H:27]):[C:17]([H:28]):[C:18]([H:29]):[C:19]:2:[C:20]:1[H:30])[H:31])N([H])[H]>>[H][N:10]([C:11]1:[C:12]([H:24]):[C:13]([H:25]):[C:14]2:[C:15]([H:26]):[C:16]([H:27]):[C:17]([H:28]):[C:18]([H:29]):[C:19]:2:[C:20]:1[H:30])[H:31]

Derived Operators

EVODEX.1-F381 - Elemental Balance

O	-2
C	-5
N	-2
H	-8

EVODEX.1-M180 - Mass Difference

-128.05864

EVODEX.1-E1175 - Reaction Operator E

[#7](-[#6](=[#8])-[#6](-[#6](-[#6@](-[#7](-[H])-[H])(-[#6](=[#8])-[#7:10](-[#6:11])-[H:27])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H]>>[#7:10](-[#6:11])(-[H:27])-[H]

EVODEX.1-C574 - Reaction Operator C

[H]-[#7](-[H])-[#6](=[#8])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#7:29])-[#7](-[H])-[H]>>[H]-[#7:29]

EVODEX.1-N729 - Reaction Operator N

[H]-[#7](-[H])-[#6](=[#8])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#7:29](-[#6@:24])-[H:128])-[#7](-[H])-[H]>>[H]-[#7:29](-[#6@:24])-[H:128]

EVODEX.1-Em1 - Reaction Operator Em

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

EVODEX.1-Cm1 - Reaction Operator Cm

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

EVODEX.1-Nm1 - Reaction Operator Nm

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

Source Full Reactions

EVODEX.1-R5490

[N:1]([C:2](=[O:3])[C:4]([C:5]([C@:6]([N:7]([H:22])[H:23])([C:8](=[O:9])[N:10]([C:11]1:[C:12]([H:24]):[C:13]([H:25]):[C:14]2:[C:15]([H:26]):[C:16]([H:27]):[C:17]([H:28]):[C:18]([H:29]):[C:19]:2:[C:20]:1[H:30])[H:31])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38].[H][O:21][H:39]>>[H][N:10]([C:11]1:[C:12]([H:24]):[C:13]([H:25]):[C:14]2:[C:15]([H:26]):[C:16]([H:27]):[C:17]([H:28]):[C:18]([H:29]):[C:19]:2:[C:20]:1[H:30])[H:31].[N:1]([C:2](=[O:3])[C:4]([C:5]([C@:6]([N:7]([H:22])[H:23])([C:8](=[O:9])[O:21][H:39])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38]