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EVODEX.1-P6515

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][N:1]([C:2]1:[N:3]:[C:4]([H:32]):[N:5]:[C:6]2:[C:7]:1:[N:8]:[C:9]([H:33]):[N:10]:2[C@@:11]([C:12]([O:13][H:34])([H:35])[H:36])([O:14][C@@:15]([C:16]([O:17][H:37])([H:38])[H:39])([C:18]([O:19][P:20](=[O:21])([O:22][H:40])[O:23][H:41])([H:42])[H:43])[H:44])[H:45])[H:46]>>[H]OC(=O)C([H])([H])[C@@]([H])(C(=O)O[H])[N:1]([C:2]1:[N:3]:[C:4]([H:32]):[N:5]:[C:6]2:[C:7]:1:[N:8]:[C:9]([H:33]):[N:10]:2[C@@:11]([C:12]([O:13][H:34])([H:35])[H:36])([O:14][C@@:15]([C:16]([O:17][H:37])([H:38])[H:39])([C:18]([O:19][P:20](=[O:21])([O:22][H:40])[O:23][H:41])([H:42])[H:43])[H:44])[H:45])[H:46]

Derived Operators

EVODEX.1-F272 - Elemental Balance

O4
C4
H4

EVODEX.1-M551 - Mass Difference

116.01092

EVODEX.1-E819 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:1](-[#6:2])(-[H:46])-[H]>>[#7:1](-[#6:2])(-[#6@](-[#6](=[#8])-[#8]-[H])(-[#6](-[#6](=[#8])-[#8]-[H])(-[H])-[H])-[H])-[H:46]

EVODEX.1-C749 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7:1]>>[H]-[#8]-[#6](=[#8])-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#8]-[H])-[#7:1]

EVODEX.1-N956 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7:1](-[#6:2])-[H:46]>>[H]-[#8]-[#6](=[#8])-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#8]-[H])-[#7:1](-[#6:2])-[H:46]

EVODEX.1-Em85 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7:1]-[#6:2]>>[#6]-[#6](-[H])(-[#6])-[#7:1]-[#6:2]

EVODEX.1-Cm5 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm121 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7:1]-[#6:2]>>[#6]-[#6](-[H])(-[#6])-[#7:1]-[#6:2]

Source Full Reactions

EVODEX.1-R7096

Full Reaction Rendering

[H][N:1]([C:2]1:[N:3]:[C:4]([H:32]):[N:5]:[C:6]2:[C:7]:1:[N:8]:[C:9]([H:33]):[N:10]:2[C@@:11]([C:12]([O:13][H:34])([H:35])[H:36])([O:14][C@@:15]([C:16]([O:17][H:37])([H:38])[H:39])([C:18]([O:19][P:20](=[O:21])([O:22][H:40])[O:23][H:41])([H:42])[H:43])[H:44])[H:45])[H:46].[O:24]=[C:25]([O:26][H:48])[C:27](=[C:28]([C:29](=[O:30])[O:31][H:49])[H:50])[H:51]>>[H][C:28]([C@:27]([N:1]([C:2]1:[N:3]:[C:4]([H:32]):[N:5]:[C:6]2:[C:7]:1:[N:8]:[C:9]([H:33]):[N:10]:2[C@@:11]([C:12]([O:13][H:34])([H:35])[H:36])([O:14][C@@:15]([C:16]([O:17][H:37])([H:38])[H:39])([C:18]([O:19][P:20](=[O:21])([O:22][H:40])[O:23][H:41])([H:42])[H:43])[H:44])[H:45])[H:46])([C:25](=[O:24])[O:26][H:48])[H:51])([C:29](=[O:30])[O:31][H:49])[H:50]