Acetic Acid → HCID 53905499, compound
Reaction equation
[C:1]([O-:2])([CH3:3])([CH3:4])[CH3:5].[C:31]([CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37])(=[O:38])[O:39][CH2:40][CH3:41].[CH3:42][C:43](=[O:44])[OH:45].[CH3:46][S:47](=[O:48])[CH3:49].[Cl:7][CH2:8][C:9](=[O:10])[c:11]1[cH:12][c:13]2[c:17]([cH:18][cH:19]1)[CH2:16][CH:15]([NH:20][S:21](=[O:22])(=[O:23])[c:24]1[cH:25][cH:26][c:27]([CH3:30])[cH:28][cH:29]1)[CH2:14]2.[K+:6].[OH2:50]>>[CH2:8]([C:9](=[O:10])[c:11]1[cH:12][c:13]2[c:17]([cH:18][cH:19]1)[CH2:16][CH:15]([NH:20][S:21](=[O:22])(=[O:23])[c:24]1[cH:25][cH:26][c:27]([CH3:30])[cH:28][cH:29]1)[CH2:14]2)[CH:32]([C:31](=[O:38])[O:39][CH2:40][CH3:41])[C:33](=[O:34])[O:35][CH2:36][CH3:37]Participants
8
Sources & evidence
- ORD record
- ord-cec34429777e40d9a592ebbd97a5a732
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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