EVODEX.1-P4243

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14](=[O:15])[O:16][C:17]([C@:18]([C:19]([O:20][P:21](=[O:22])([O:23][H:48])[O:24][C:25]([C:26]([N+:27]([C:28]([H:49])([H:50])[H:51])([C:29]([H:52])([H:53])[H:54])[C:30]([H:55])([H:56])[H:57])([H:58])[H:59])([H:60])[H:61])([H:62])[H:63])([O:31][C:32](=[O:33])[C:34]([C:35]([C:36]([C:37]([C:38]([C:39]([C:40]([C:41]([C:42]([C:43]([C:44]([C:45]([C:46]([H:64])([H:65])[H:66])([H:67])[H:68])([H:69])[H:70])([H:71])[H:72])([H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[H:80])([H:81])[H:82])([H:83])[H:84])([H:85])[H:86])([H:87])[H:88])([H:89])[H:90])[H:91])([H:92])[H:93])([H:94])[H:95])([H:96])[H:97])([H:98])[H:99])([H:100])[H:101])([H:102])[H:103])([H:104])[H:105])([H:106])[H:107])([H:108])[H:109])([H:110])[H:111])([H:112])[H:113])([H:114])[H:115])([H:116])[H:117])([H:118])([H:119])[H:120].[H][O:47][H:121]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14](=[O:15])[O:16][C:17]([C:18]([C:19]([O:47][H:121])([H:62])[H:63])([O:31][C:32](=[O:33])[C:34]([C:35]([C:36]([C:37]([C:38]([C:39]([C:40]([C:41]([C:42]([C:43]([C:44]([C:45]([C:46]([H:64])([H:65])[H:66])([H:67])[H:68])([H:69])[H:70])([H:71])[H:72])([H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[H:80])([H:81])[H:82])([H:83])[H:84])([H:85])[H:86])([H:87])[H:88])([H:89])[H:90])[H:91])([H:92])[H:93])([H:94])[H:95])([H:96])[H:97])([H:98])[H:99])([H:100])[H:101])([H:102])[H:103])([H:104])[H:105])([H:106])[H:107])([H:108])[H:109])([H:110])[H:111])([H:112])[H:113])([H:114])[H:115])([H:116])[H:117])([H:118])([H:119])[H:120].[H][O:20][P:21](=[O:22])([O:23][H:48])[O:24][C:25]([C:26]([N+:27]([C:28]([H:49])([H:50])[H:51])([C:29]([H:52])([H:53])[H:54])[C:30]([H:55])([H:56])[H:57])([H:58])[H:59])([H:60])[H:61]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E225 - Reaction Operator E

Reaction Operator E SMIRKS

[#15:3]-[#8:5]-[#6:6](-[#6@:7](-[#8:8])(-[#6:9])-[H:28])(-[H:29])-[H:30].[#8:1](-[H:42])-[H]>>[#15:3]-[#8:5]-[H].[#8:1](-[#6:6](-[#6:7](-[#8:8])(-[#6:9])-[H:28])(-[H:29])-[H:30])-[H:42]

EVODEX.1-C521 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:21](-[#6@:20])-[#8:22].[H]-[#8:51]>>[#6:20]-[#6:21]-[#8:51].[H]-[#8:22]

EVODEX.1-N662 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:19]-[#6@:20](-[#6:21](-[#8:22]-[#15:23])(-[H:66])-[H:67])(-[#8:33])-[H:99].[H]-[#8:51]-[H:133]>>[#6:19]-[#6:20](-[#6:21](-[#8:51]-[H:133])(-[H:66])-[H:67])(-[#8:33])-[H:99].[H]-[#8:22]-[#15:23]

EVODEX.1-Em121 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:8]-[#6:9]-[#8:10]-[#15:11].[H]-[#8:26]>>[#6:8]-[#6:9]-[#8:26].[H]-[#8:10]-[#15:11]

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-Nm155 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:8]-[#6:9]-[#8:10]-[#15:11].[H]-[#8:26]>>[#6:8]-[#6:9]-[#8:26].[H]-[#8:10]-[#15:11]

Source Full Reactions

EVODEX.1-R5091

Full Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14](=[O:15])[O:16][C:17]([C@:18]([C:19]([O:20][P:21](=[O:22])([O:23][H:48])[O:24][C:25]([C:26]([N+:27]([C:28]([H:49])([H:50])[H:51])([C:29]([H:52])([H:53])[H:54])[C:30]([H:55])([H:56])[H:57])([H:58])[H:59])([H:60])[H:61])([H:62])[H:63])([O:31][C:32](=[O:33])[C:34]([C:35]([C:36]([C:37]([C:38]([C:39]([C:40]([C:41]([C:42]([C:43]([C:44]([C:45]([C:46]([H:64])([H:65])[H:66])([H:67])[H:68])([H:69])[H:70])([H:71])[H:72])([H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[H:80])([H:81])[H:82])([H:83])[H:84])([H:85])[H:86])([H:87])[H:88])([H:89])[H:90])[H:91])([H:92])[H:93])([H:94])[H:95])([H:96])[H:97])([H:98])[H:99])([H:100])[H:101])([H:102])[H:103])([H:104])[H:105])([H:106])[H:107])([H:108])[H:109])([H:110])[H:111])([H:112])[H:113])([H:114])[H:115])([H:116])[H:117])([H:118])([H:119])[H:120].[H][O:47][H:121]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14](=[O:15])[O:16][C:17]([C:18]([C:19]([O:47][H:121])([H:62])[H:63])([O:31][C:32](=[O:33])[C:34]([C:35]([C:36]([C:37]([C:38]([C:39]([C:40]([C:41]([C:42]([C:43]([C:44]([C:45]([C:46]([H:64])([H:65])[H:66])([H:67])[H:68])([H:69])[H:70])([H:71])[H:72])([H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[H:80])([H:81])[H:82])([H:83])[H:84])([H:85])[H:86])([H:87])[H:88])([H:89])[H:90])[H:91])([H:92])[H:93])([H:94])[H:95])([H:96])[H:97])([H:98])[H:99])([H:100])[H:101])([H:102])[H:103])([H:104])[H:105])([H:106])[H:107])([H:108])[H:109])([H:110])[H:111])([H:112])[H:113])([H:114])[H:115])([H:116])[H:117])([H:118])([H:119])[H:120].[H][O:20][P:21](=[O:22])([O:23][H:48])[O:24][C:25]([C:26]([N+:27]([C:28]([H:49])([H:50])[H:51])([C:29]([H:52])([H:53])[H:54])[C:30]([H:55])([H:56])[H:57])([H:58])[H:59])([H:60])[H:61]