SMIRKS
[H][O:28][C:27]([H:67])([H:68])[H:69]>>[H]C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)[O:28][C:27]([H:67])([H:68])[H:69]
Derived Operators
EVODEX.1-F28 - Elemental Balance
| C | 14 |
| O | 1 |
| H | 26 |
EVODEX.1-M96 - Mass Difference
210.19848
EVODEX.1-E469 - Reaction Operator E
[#6:27]-[#8:28]-[H]>>[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](=[#8])-[#8:28]-[#6:27])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])(-[H])-[H]
EVODEX.1-C330 - Reaction Operator C
[H]-[#8:28]>>[H]-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#8:28]
EVODEX.1-N383 - Reaction Operator N
[H]-[#8:28]-[#6:27]>>[H]-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#8:28]-[#6:27]
Source Full Reactions
EVODEX.1-R6209
[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])[N:16]([C:17]([C:18]1:[C:19]([H:29]):[C:20]([H:30]):[C:21]([O:22][H:31]):[C:23]([O:24][C:25]([H:32])([H:33])[H:34]):[C:26]:1[H:35])([H:36])[H:37])[H:38])([H:39])[H:40])([H:41])[H:42])([H:43])[H:44])([H:45])[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([H:55])[H:56])([H:57])[H:58])([H:59])[H:60])([H:61])[H:62])([H:63])([H:64])[H:65].[H][O:28][C:27]([H:67])([H:68])[H:69]>>[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:28][C:27]([H:67])([H:68])[H:69])([H:39])[H:40])([H:41])[H:42])([H:43])[H:44])([H:45])[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([H:55])[H:56])([H:57])[H:58])([H:59])[H:60])([H:61])[H:62])([H:63])([H:64])[H:65].[H][N:16]([C:17]([C:18]1:[C:19]([H:29]):[C:20]([H:30]):[C:21]([O:22][H:31]):[C:23]([O:24][C:25]([H:32])([H:33])[H:34]):[C:26]:1[H:35])([H:36])[H:37])[H:38]