Acetic Acid → HCID 18450890, compound
Reaction equation
[CH3:42][C:43]([OH:44])=[O:45].[NH2:1][c:2]1[n:3][cH:4][c:5]([C:32](=[O:33])[NH:34][CH2:35][CH:36]2[NH:37][CH2:38][CH2:39][CH2:40][CH2:41]2)[c:6]2[c:7]1[c:8](-[c:11]1[cH:12][c:13]([O:30][CH3:31])[c:14]([NH:17][C:18](=[O:19])[c:20]3[n:21]([CH3:29])[c:22]4[cH:23][cH:24][cH:25][cH:26][c:27]4[cH:28]3)[cH:15][cH:16]1)[cH:9][s:10]2>>[NH2:1][c:2]1[n:3][cH:4][c:5]([C:32](=[O:33])[NH:34][CH2:35][CH:36]2[N:37]([C:43]([CH3:42])=[O:44])[CH2:38][CH2:39][CH2:40][CH2:41]2)[c:6]2[c:7]1[c:8](-[c:11]1[cH:12][c:13]([O:30][CH3:31])[c:14]([NH:17][C:18](=[O:19])[c:20]3[n:21]([CH3:29])[c:22]4[cH:23][cH:24][cH:25][cH:26][c:27]4[cH:28]3)[cH:15][cH:16]1)[cH:9][s:10]2Participants
3
Sources & evidence
- ORD record
- ord-37b6af87e1be4f399a17791661954d49
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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