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EVODEX.1-P477

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]C([H])([H])[O:2][C:3]([H:50])([H:51])[H:52].O=[O:48]>>[H][O:48][H].[H][O:2][C:3]([H:50])([H:51])[H:52]

Derived Operators

EVODEX.1-F136 - Elemental Balance

C-1
O-1

EVODEX.1-M245 - Mass Difference

-27.9949

EVODEX.1-E510 - Reaction Operator E

Reaction Operator E SMIRKS

[#6](-[#8:2]-[#6:3])(-[H])(-[H])-[H].[#8:59]=[#8]>>[#8:59](-[H])-[H].[#8:2](-[#6:3])-[H]

EVODEX.1-C212 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6](-[H])(-[H])-[#8:2].[#8]=[#8:59]>>[H]-[#8:59]-[H].[H]-[#8:2]

EVODEX.1-N188 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6](-[H])(-[H])-[#8:2]-[#6:3].[#8]=[#8:59]>>[H]-[#8:59]-[H].[H]-[#8:2]-[#6:3]

EVODEX.1-Em270 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6](-[H])(-[H])-[#8:2]-[#6:3].[#8]=[#8:59]>>[H]-[#8:59]-[H].[H]-[#8:2]-[#6:3]

EVODEX.1-Cm190 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6]-[#8:2].[#8]=[#8:59]>>[H]-[#8:59]-[H].[H]-[#8:2]

EVODEX.1-Nm268 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6](-[H])(-[H])-[#8:2]-[#6:3].[#8]=[#8:59]>>[H]-[#8:59]-[H].[H]-[#8:2]-[#6:3]

Source Full Reactions

EVODEX.1-R458

Full Reaction Rendering

[H][C:1]([O:2][C:3]([H:50])([H:51])[H:52])([H:53])[H:54].[HH].[H][C:47]1([H:81])[C:7]([C:5]([N:4]([H:83])[H:84])=[O:6])=[C:8]([H:56])[N:9]([C@:10]2([H:57])[O:11][C@@:12]([C:13]([O:14][P:15](=[O:16])([O:17][H:58])[O:18][P:19](=[O:20])([O:21][H:59])[O:22][C:23]([C@@:24]3([H:60])[O:25][C@:26]([N:27]4:[C:28]([H:61]):[N:29]:[C:30]5:[C:31]([N:32]([H:62])[H:63]):[N:33]:[C:34]([H:64]):[N:35]:[C:36]:4:5)([H:65])[C@@:37]([O:38][H:66])([H:67])[C@@:39]3([O:40][H:68])[H:69])([H:70])[H:71])([H:72])[H:73])([H:74])[C@:41]([O:42][H:75])([H:76])[C@:43]2([O:44][H:77])[H:78])[C:45]([H:79])=[C:46]1[H:80].[O:48]=[O:49]>>[C:1](=[O:49])([H:53])[H:54].[N:4]([C:5](=[O:6])[C:7]1:[C:8]([H:56]):[N+:9]([C@:10]2([H:57])[O:11][C@@:12]([C:13]([O:14][P:15](=[O:16])([O:17][H:58])[O:18][P:19](=[O:20])([O:21][H:59])[O:22][C:23]([C@@:24]3([H:60])[O:25][C@:26]([N:27]4:[C:28]([H:61]):[N:29]:[C:30]5:[C:31]([N:32]([H:62])[H:63]):[N:33]:[C:34]([H:64]):[N:35]:[C:36]:4:5)([H:65])[C@@:37]([O:38][H:66])([H:67])[C@@:39]3([O:40][H:68])[H:69])([H:70])[H:71])([H:72])[H:73])([H:74])[C@:41]([O:42][H:75])([H:76])[C@:43]2([O:44][H:77])[H:78]):[C:45]([H:79]):[C:46]([H:80]):[C:47]:1[H:81])([H:83])[H:84].[H][O:48][H].[H][O:2][C:3]([H:50])([H:51])[H:52]

EVODEX.1-R459

Full Reaction Rendering

[H][C:1]([O:2][C:3]([H:54])([H:55])[H:56])([H:57])[H:58].[HH].[H][C:51]1([H:86])[C:7]([C:5]([N:4]([H:88])[H:89])=[O:6])=[C:8]([H:60])[N:9]([C@:10]2([H:61])[O:11][C@@:12]([C:13]([O:14][P:15](=[O:16])([O:17][H:62])[O:18][P:19](=[O:20])([O:21][H:63])[O:22][C:23]([C@@:24]3([H:64])[O:25][C@:26]([N:27]4:[C:28]([H:65]):[N:29]:[C:30]5:[C:31]([N:32]([H:66])[H:67]):[N:33]:[C:34]([H:68]):[N:35]:[C:36]:4:5)([H:69])[C@@:37]([O:38][P:39](=[O:40])([O:41][H:70])[O:42][H:71])([H:72])[C@@:43]3([O:44][H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[C@:45]([O:46][H:80])([H:81])[C@:47]2([O:48][H:82])[H:83])[C:49]([H:84])=[C:50]1[H:85].[O:52]=[O:53]>>[C:1](=[O:53])([H:57])[H:58].[N:4]([C:5](=[O:6])[C:7]1:[C:8]([H:60]):[N+:9]([C@:10]2([H:61])[O:11][C@@:12]([C:13]([O:14][P:15](=[O:16])([O:17][H:62])[O:18][P:19](=[O:20])([O:21][H:63])[O:22][C:23]([C@@:24]3([H:64])[O:25][C@:26]([N:27]4:[C:28]([H:65]):[N:29]:[C:30]5:[C:31]([N:32]([H:66])[H:67]):[N:33]:[C:34]([H:68]):[N:35]:[C:36]:4:5)([H:69])[C@@:37]([O:38][P:39](=[O:40])([O:41][H:70])[O:42][H:71])([H:72])[C@@:43]3([O:44][H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[C@:45]([O:46][H:80])([H:81])[C@:47]2([O:48][H:82])[H:83]):[C:49]([H:84]):[C:50]([H:85]):[C:51]:1[H:86])([H:88])[H:89].[H][O:52][H].[H][O:2][C:3]([H:54])([H:55])[H:56]