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EVODEX.1-P1288

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][N:2]([C:1]([H:75])([H:76])[H:77])[C:3]([C:4]([C:5]1:[C:6]([H:64]):[N:7]([H:65]):[C:8]2:[C:9]([H:66]):[C:10]([H:67]):[C:11]([H:68]):[C:12]([H:69]):[C:13]:1:2)([H:70])[H:71])([H:72])[H:73]>>[H]C([H])([H])[N:2]([C:1]([H:75])([H:76])[H:77])[C:3]([C:4]([C:5]1:[C:6]([H:64]):[N:7]([H:65]):[C:8]2:[C:9]([H:66]):[C:10]([H:67]):[C:11]([H:68]):[C:12]([H:69]):[C:13]:1:2)([H:70])[H:71])([H:72])[H:73]

Derived Operators

EVODEX.1-F94 - Elemental Balance

C1
H2

EVODEX.1-M22 - Mass Difference

14.01566

EVODEX.1-E676 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:18]-[#7:19](-[H])-[#6@@:20]>>[#6:18]-[#7:19](-[#6](-[H])(-[H])-[H])-[#6@@:20]

EVODEX.1-C157 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N273 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7:6](-[#6:1])-[#6:5]>>[H]-[#6](-[H])(-[H])-[#7:6](-[#6:1])-[#6:5]

EVODEX.1-Em398 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7:6](-[#6:1])-[#6:5]>>[H]-[#6](-[H])(-[H])-[#7:6](-[#6:1])-[#6:5]

EVODEX.1-Cm5 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm358 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7:6](-[#6:1])-[#6:5]>>[H]-[#6](-[H])(-[H])-[#7:6](-[#6:1])-[#6:5]

Source Full Reactions

EVODEX.1-R1647

Full Reaction Rendering

[C:14]([S+:15]([C:16]([C:17]([C@:18]([N:19]([H:41])[H:42])([C:20](=[O:21])[O:22][H:43])[H:44])([H:45])[H:46])([H:47])[H:48])[C:23]([C@@:24]1([H:49])[O:25][C@:26]([N:27]2:[C:28]([H:50]):[N:29]:[C:30]3:[C:31]([N:32]([H:51])[H:52]):[N:33]:[C:34]([H:53]):[N:35]:[C:36]:2:3)([H:54])[C@@:37]([O:38][H:55])([H:56])[C@@:39]1([O:40][H:57])[H:58])([H:59])[H:60])([H:61])([H:62])[H:63].[H][N:2]([C:1]([H:75])([H:76])[H:77])[C:3]([C:4]([C:5]1:[C:6]([H:64]):[N:7]([H:65]):[C:8]2:[C:9]([H:66]):[C:10]([H:67]):[C:11]([H:68]):[C:12]([H:69]):[C:13]:1:2)([H:70])[H:71])([H:72])[H:73]>>[C:1]([N:2]([C:3]([C:4]([C:5]1:[C:6]([H:64]):[N:7]([H:65]):[C:8]2:[C:9]([H:66]):[C:10]([H:67]):[C:11]([H:68]):[C:12]([H:69]):[C:13]:1:2)([H:70])[H:71])([H:72])[H:73])[C:14]([H:61])([H:62])[H:63])([H:75])([H:76])[H:77].[HH].[S:15]([C:16]([C:17]([C@:18]([N:19]([H:41])[H:42])([C:20](=[O:21])[O:22][H:43])[H:44])([H:45])[H:46])([H:47])[H:48])[C:23]([C@@:24]1([H:49])[O:25][C@:26]([N:27]2:[C:28]([H:50]):[N:29]:[C:30]3:[C:31]([N:32]([H:51])[H:52]):[N:33]:[C:34]([H:53]):[N:35]:[C:36]:2:3)([H:54])[C@@:37]([O:38][H:55])([H:56])[C@@:39]1([O:40][H:57])[H:58])([H:59])[H:60]