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EVODEX.1-P1239

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][N:8]([C:7]([C:6]([C:5]([C:4]([C@:3]([N:2]([C:1]([H:75])([H:76])[H:77])[H:74])([C:9](=[O:10])[O:11][H:72])[H:73])([H:70])[H:71])([H:68])[H:69])([H:66])[H:67])([H:64])[H:65])[H:62]>>[H]C([H])([H])[N:8]([C:7]([C:6]([C:5]([C:4]([C@:3]([N:2]([C:1]([H:75])([H:76])[H:77])[H:74])([C:9](=[O:10])[O:11][H:72])[H:73])([H:70])[H:71])([H:68])[H:69])([H:66])[H:67])([H:64])[H:65])[H:62]

Derived Operators

EVODEX.1-F94 - Elemental Balance

C1
H2

EVODEX.1-M22 - Mass Difference

14.01566

EVODEX.1-E624 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:28](-[#6:29])(-[H:66])-[H]>>[#6](-[#7:28](-[#6:29])-[H:66])(-[H])(-[H])-[H]

EVODEX.1-C157 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N98 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7:28](-[#6:29])-[H:72]>>[H]-[#6](-[H])(-[H])-[#7:28](-[#6:29])-[H:72]

EVODEX.1-Em150 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7:28]-[#6:29]>>[H]-[#6](-[H])(-[H])-[#7:28]-[#6:29]

EVODEX.1-Cm5 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm177 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7:28]-[#6:29]>>[H]-[#6](-[H])(-[H])-[#7:28]-[#6:29]

Source Full Reactions

EVODEX.1-R1265

Full Reaction Rendering

[C:12]([S+:13]([C:14]([C:15]([C@:16]([N:17]([H:39])[H:40])([C:18](=[O:19])[O:20][H:41])[H:42])([H:43])[H:44])([H:45])[H:46])[C:21]([C@@:22]1([H:47])[O:23][C@:24]([N:25]2:[C:26]([H:48]):[N:27]:[C:28]3:[C:29]([N:30]([H:49])[H:50]):[N:31]:[C:32]([H:51]):[N:33]:[C:34]:2:3)([H:52])[C@@:35]([O:36][H:53])([H:54])[C@@:37]1([O:38][H:55])[H:56])([H:57])[H:58])([H:59])([H:60])[H:61].[H][N:8]([C:7]([C:6]([C:5]([C:4]([C@:3]([N:2]([C:1]([H:75])([H:76])[H:77])[H:74])([C:9](=[O:10])[O:11][H:72])[H:73])([H:70])[H:71])([H:68])[H:69])([H:66])[H:67])([H:64])[H:65])[H:62]>>[C:1]([N:2]([C@@:3]([C:4]([C:5]([C:6]([C:7]([N:8]([C:12]([H:59])([H:60])[H:61])[H:62])([H:64])[H:65])([H:66])[H:67])([H:68])[H:69])([H:70])[H:71])([C:9](=[O:10])[O:11][H:72])[H:73])[H:74])([H:75])([H:76])[H:77].[HH].[S:13]([C:14]([C:15]([C@:16]([N:17]([H:39])[H:40])([C:18](=[O:19])[O:20][H:41])[H:42])([H:43])[H:44])([H:45])[H:46])[C:21]([C@@:22]1([H:47])[O:23][C@:24]([N:25]2:[C:26]([H:48]):[N:27]:[C:28]3:[C:29]([N:30]([H:49])[H:50]):[N:31]:[C:32]([H:51]):[N:33]:[C:34]:2:3)([H:52])[C@@:35]([O:36][H:53])([H:54])[C@@:37]1([O:38][H:55])[H:56])([H:57])[H:58]