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EVODEX.1-P5995

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([N:2]([C:3]1:[C:4]([H:43]):[C:5]([H:44]):[C:6]([C:7](=[O:8])[O:9][C:10]2([H:45])[C:11]([O:12][H:46])([H:47])[C@@:13]([N:14]3:[C:15]([H:48]):[N:16]:[C:17]4:[C:18]([N:19]([H:49])[H:50]):[N:20]:[C:21]([H:51]):[N:22]:[C:23]:3:4)([H:52])[O:24][C@@:25]2([O:26][P:27](=[O:28])([O:29][H:53])[O:30][P:31](=[O:32])([O:33][H:54])[O:34][P:35](=[O:36])([O:37][H:55])[O:38][H:56])[H:57]):[C:39]([H:58]):[C:40]:1[H:59])[H:60])([H:61])([H:62])[H:63].[H][O:41][H:64].[H][O:42][H:66]>>[C:1]([N:2]([C:3]1:[C:4]([H:43]):[C:5]([H:44]):[C:6]([C:7](=[O:8])[O:9][C:10]2([H:45])[C:11]([O:12][H:46])([H:47])[C@@:13]([N:14]3:[C:15]([H:48]):[N:16]:[C:17]4:[C:18]([N:19]([H:49])[H:50]):[N:20]:[C:21]([H:51]):[N:22]:[C:23]:3:4)([H:52])[O:24][C@@:25]2([O:26][P:27](=[O:28])([O:29][H:53])[O:41][H:64])[H:57]):[C:39]([H:58]):[C:40]:1[H:59])[H:60])([H:61])([H:62])[H:63].[H][O:30][P:31](=[O:32])([O:33][H:54])[O:42][H:66].[H][O:34][P:35](=[O:36])([O:37][H:55])[O:38][H:56]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E320 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:12]-[#15:13](=[#8:14])(-[#8:15])-[#8:16]-[#15:17](=[#8:18])(-[#8:19])-[#8:20]-[#15:21].[#8:1](-[H:38])-[H].[#8:2](-[H:40])-[H]>>[#8:1](-[#15:13](-[#8:12])(=[#8:14])-[#8:15])-[H:38].[#8:20](-[#15:21])-[H].[#8:2](-[#15:17](-[#8:16]-[H])(=[#8:18])-[#8:19])-[H:40]

EVODEX.1-C719 - Reaction Operator C

Reaction Operator C SMIRKS

[#15:4]-[#8:7]-[#15:8]-[#8:11].[H]-[#8:1].[H]-[#8:2]>>[H]-[#8:11].[H]-[#8:7]-[#15:8]-[#8:1].[#8:2]-[#15:4]

EVODEX.1-N886 - Reaction Operator N

Reaction Operator N SMIRKS

[#8:3]=[#15:4](-[#8:5])(-[#8:6])-[#8:7]-[#15:8](=[#8:9])(-[#8:10])-[#8:11]-[#15:12].[H]-[#8:1]-[H:38].[H]-[#8:2]-[H:40]>>[H]-[#8:11]-[#15:12].[H]-[#8:7]-[#15:8](-[#8:1]-[H:38])(=[#8:9])-[#8:10].[#8:2](-[#15:4](=[#8:3])(-[#8:5])-[#8:6])-[H:40]

EVODEX.1-Em698 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8:3]=[#15:4](-[#8:5])(-[#8:6])-[#8:7]-[#15:8](=[#8:9])(-[#8:10])-[#8:11]-[#15:12].[H]-[#8:1].[H]-[#8:2]>>[H]-[#8:11]-[#15:12].[H]-[#8:7]-[#15:8](-[#8:1])(=[#8:9])-[#8:10].[#8:2]-[#15:4](=[#8:3])(-[#8:5])-[#8:6]

EVODEX.1-Cm284 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#15:4]-[#8:7]-[#15:8]-[#8:11].[H]-[#8:1].[H]-[#8:2]>>[H]-[#8:11].[H]-[#8:7]-[#15:8]-[#8:1].[#8:2]-[#15:4]

EVODEX.1-Nm627 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#8:3]=[#15:4](-[#8:5])(-[#8:6])-[#8:7]-[#15:8](=[#8:9])(-[#8:10])-[#8:11]-[#15:12].[H]-[#8:1].[H]-[#8:2]>>[H]-[#8:11]-[#15:12].[H]-[#8:7]-[#15:8](-[#8:1])(=[#8:9])-[#8:10].[#8:2]-[#15:4](=[#8:3])(-[#8:5])-[#8:6]

Source Full Reactions

EVODEX.1-R6639

Full Reaction Rendering

[C:1]([N:2]([C:3]1:[C:4]([H:43]):[C:5]([H:44]):[C:6]([C:7](=[O:8])[O:9][C:10]2([H:45])[C:11]([O:12][H:46])([H:47])[C@@:13]([N:14]3:[C:15]([H:48]):[N:16]:[C:17]4:[C:18]([N:19]([H:49])[H:50]):[N:20]:[C:21]([H:51]):[N:22]:[C:23]:3:4)([H:52])[O:24][C@@:25]2([O:26][P:27](=[O:28])([O:29][H:53])[O:30][P:31](=[O:32])([O:33][H:54])[O:34][P:35](=[O:36])([O:37][H:55])[O:38][H:56])[H:57]):[C:39]([H:58]):[C:40]:1[H:59])[H:60])([H:61])([H:62])[H:63].[H][O:41][H:64].[H][O:42][H:66]>>[C:1]([N:2]([C:3]1:[C:4]([H:43]):[C:5]([H:44]):[C:6]([C:7](=[O:8])[O:9][C:10]2([H:45])[C:11]([O:12][H:46])([H:47])[C@@:13]([N:14]3:[C:15]([H:48]):[N:16]:[C:17]4:[C:18]([N:19]([H:49])[H:50]):[N:20]:[C:21]([H:51]):[N:22]:[C:23]:3:4)([H:52])[O:24][C@@:25]2([O:26][P:27](=[O:28])([O:29][H:53])[O:41][H:64])[H:57]):[C:39]([H:58]):[C:40]:1[H:59])[H:60])([H:61])([H:62])[H:63].[H][O:30][P:31](=[O:32])([O:33][H:54])[O:42][H:66].[H][O:34][P:35](=[O:36])([O:37][H:55])[O:38][H:56]