EVODEX.1-P4442

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[O:1]([C:2]([C@:3]1([H:47])[O:4][C@:5]([O:6][C:7]([C@:8]2([H:48])[O:9][C@@:10]([O:11][H:49])([H:50])[C@:12]([O:13][H:51])([H:52])[C@@:14]([O:15][H:53])([H:54])[C@:16]2([O:17][H:55])[H:56])([H:57])[H:58])([H:59])[C@:18]([O:19][H:60])([H:61])[C@@:20]([O:21][H:62])([H:63])[C@:22]1([O:23][H:64])[H:65])([H:66])[H:67])[H:68].[H][O:24][C:25]([C@:26]1([H:69])[O:27][C@:28]([O:29][C:30]([C@:31]2([H:70])[O:32][C@@:33]([O:34][H:71])([H:72])[C@:35]([O:36][H:73])([H:74])[C@@:37]([O:38][H:75])([H:76])[C@:39]2([O:40][H:77])[H:78])([H:79])[H:80])([H:81])[C@:41]([O:42][H:82])([H:83])[C@@:43]([O:44][H:84])([H:85])[C@:45]1([O:46][H:86])[H:87])([H:88])[H:89]>>[O:1]([C:2]([C@:3]1([H:47])[O:4][C@@:5]([O:24][C:25]([C@:26]2([H:69])[O:27][C@:28]([O:29][C:30]([C@:31]3([H:70])[O:32][C@@:33]([O:34][H:71])([H:72])[C@:35]([O:36][H:73])([H:74])[C@@:37]([O:38][H:75])([H:76])[C@:39]3([O:40][H:77])[H:78])([H:79])[H:80])([H:81])[C@:41]([O:42][H:82])([H:83])[C@@:43]([O:44][H:84])([H:85])[C@:45]2([O:46][H:86])[H:87])([H:88])[H:89])([H:59])[C@:18]([O:19][H:60])([H:61])[C@@:20]([O:21][H:62])([H:63])[C@:22]1([O:23][H:64])[H:65])([H:66])[H:67])[H:68].[H][O:6][C:7]([C@:8]1([H:48])[O:9][C@@:10]([O:11][H:49])([H:50])[C@:12]([O:13][H:51])([H:52])[C@@:14]([O:15][H:53])([H:54])[C@:16]1([O:17][H:55])[H:56])([H:57])[H:58]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E212 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:24]-[#6@@:25](-[#6@:5])(-[#8:26]-[#6:27])-[H:70].[#8:36](-[#6:37])-[H]>>[#8:24]-[#6@:25](-[#6@:5])(-[#8:36]-[#6:37])-[H:70].[#8:26](-[#6:27])-[H]

EVODEX.1-C1 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:5]-[#8:6].[H]-[#8:44]>>[#6:5]-[#8:44].[H]-[#8:6]

EVODEX.1-N21 - Reaction Operator N

Reaction Operator N SMIRKS

[#8:24]-[#6@@:25](-[#6@:5])(-[#8:26]-[#6:27])-[H:66].[H]-[#8:42]-[#6:41]>>[#8:24]-[#6@:25](-[#6@:5])(-[#8:42]-[#6:41])-[H:66].[H]-[#8:26]-[#6:27]

EVODEX.1-Em44 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:5]-[#6:25](-[#8:24])-[#8:26]-[#6:27].[H]-[#8:42]-[#6:41]>>[#6:5]-[#6:25](-[#8:24])-[#8:42]-[#6:41].[H]-[#8:26]-[#6:27]

EVODEX.1-Cm2 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:5]-[#8:6].[H]-[#8:44]>>[#6:5]-[#8:44].[H]-[#8:6]

EVODEX.1-Nm47 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:5]-[#6:25](-[#8:24])-[#8:26]-[#6:27].[H]-[#8:42]-[#6:41]>>[#6:5]-[#6:25](-[#8:24])-[#8:42]-[#6:41].[H]-[#8:26]-[#6:27]

Source Full Reactions

EVODEX.1-R5277

Full Reaction Rendering

[O:1]([C:2]([C@:3]1([H:47])[O:4][C@:5]([O:6][C:7]([C@:8]2([H:48])[O:9][C@@:10]([O:11][H:49])([H:50])[C@:12]([O:13][H:51])([H:52])[C@@:14]([O:15][H:53])([H:54])[C@:16]2([O:17][H:55])[H:56])([H:57])[H:58])([H:59])[C@:18]([O:19][H:60])([H:61])[C@@:20]([O:21][H:62])([H:63])[C@:22]1([O:23][H:64])[H:65])([H:66])[H:67])[H:68].[H][O:24][C:25]([C@:26]1([H:69])[O:27][C@:28]([O:29][C:30]([C@:31]2([H:70])[O:32][C@@:33]([O:34][H:71])([H:72])[C@:35]([O:36][H:73])([H:74])[C@@:37]([O:38][H:75])([H:76])[C@:39]2([O:40][H:77])[H:78])([H:79])[H:80])([H:81])[C@:41]([O:42][H:82])([H:83])[C@@:43]([O:44][H:84])([H:85])[C@:45]1([O:46][H:86])[H:87])([H:88])[H:89]>>[O:1]([C:2]([C@:3]1([H:47])[O:4][C@@:5]([O:24][C:25]([C@:26]2([H:69])[O:27][C@:28]([O:29][C:30]([C@:31]3([H:70])[O:32][C@@:33]([O:34][H:71])([H:72])[C@:35]([O:36][H:73])([H:74])[C@@:37]([O:38][H:75])([H:76])[C@:39]3([O:40][H:77])[H:78])([H:79])[H:80])([H:81])[C@:41]([O:42][H:82])([H:83])[C@@:43]([O:44][H:84])([H:85])[C@:45]2([O:46][H:86])[H:87])([H:88])[H:89])([H:59])[C@:18]([O:19][H:60])([H:61])[C@@:20]([O:21][H:62])([H:63])[C@:22]1([O:23][H:64])[H:65])([H:66])[H:67])[H:68].[H][O:6][C:7]([C@:8]1([H:48])[O:9][C@@:10]([O:11][H:49])([H:50])[C@:12]([O:13][H:51])([H:52])[C@@:14]([O:15][H:53])([H:54])[C@:16]1([O:17][H:55])[H:56])([H:57])[H:58]