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EVODEX.1-P3499

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][N:3]([C:2](=[N:1][H:56])[N:4]([H:54])[H:55])[H:52]>>[H]OP(=O)(O[H])[N:3]([C:2](=[N:1][H:56])[N:4]([H:54])[H:55])[H:52]

Derived Operators

EVODEX.1-F273 - Elemental Balance

P1
O3
H1

EVODEX.1-M13 - Mass Difference

79.96633

EVODEX.1-E1024 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:10]-[#7:12](-[H:46])-[H]>>[#6:10]-[#7:12](-[#15](=[#8])(-[#8]-[H])-[#8]-[H])-[H:46]

EVODEX.1-C475 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7:9]>>[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#7:9]

EVODEX.1-N579 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7:9](-[#6@@:8])-[H:62]>>[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#7:9](-[#6@@:8])-[H:62]

EVODEX.1-Em560 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7:9]-[#6:8]>>[#8]-[#15](=[#8])(-[#8])-[#7:9]-[#6:8]

EVODEX.1-Cm253 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#7:9]>>[#15]-[#7:9]

EVODEX.1-Nm506 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7:9]-[#6:8]>>[#8]-[#15](=[#8])(-[#8])-[#7:9]-[#6:8]

Source Full Reactions

EVODEX.1-R4194

Full Reaction Rendering

[N:5]([C:6]1:[N:7]:[C:8]([H:36]):[N:9]:[C:10]2:[C:11]:1:[N:12]:[C:13]([H:37]):[N:14]:2[C@:15]1([H:38])[O:16][C@@:17]([C:18]([O:19][P:20](=[O:21])([O:22][H:39])[O:23][P:24](=[O:25])([O:26][H:40])[O:27][P:28](=[O:29])([O:30][H:41])[O:31][H:42])([H:43])[H:44])([H:45])[C@:32]([O:33][H:46])([H:47])[C@:34]1([O:35][H:48])[H:49])([H:50])[H:51].[H][N:3]([C:2](=[N:1][H:56])[N:4]([H:54])[H:55])[H:52]>>[H][O:27][P:24]([O:23][P:20]([O:19][C:18]([C@@:17]1([H:45])[O:16][C@:15]([N:14]2:[C:10]3:[N:9]:[C:8]([H:36]):[N:7]:[C:6]([N:5]([H:50])[H:51]):[C:11]:3:[N:12]:[C:13]:2[H:37])([H:38])[C@@:34]([O:35][H:48])([H:49])[C@@:32]1([O:33][H:46])[H:47])([H:43])[H:44])(=[O:21])[O:22][H:39])(=[O:25])[O:26][H:40].[N:1](=[C:2]([N:3]([P:28](=[O:29])([O:30][H:41])[O:31][H:42])[H:52])[N:4]([H:54])[H:55])[H:56]