Acetate → HCID 178442545, compound
Reaction equation
[CH3:46][C:47](=[O:48])[O-:49].[CH3:51][C:52](=[O:53])[OH:54].[Na+:45].[O:1]=[Cr:2](=[O:3])=[O:4].[OH2:50].[OH:5][CH:6]1[CH:7]([CH:8]([CH2:9][CH2:10][CH2:11][CH:12]([CH2:13][N:14]2[C:15](=[O:24])[c:16]3[c:17]([cH:20][cH:21][cH:22][cH:23]3)[C:18]2=[O:19])[CH3:25])[CH3:26])[C:27]2([CH3:44])[CH2:28][CH2:29][CH:30]3[C:31]4([CH3:43])[CH2:32][CH2:33][CH:34]([OH:42])[CH2:35][C:36]4=[CH:37][CH2:38][CH:39]3[CH:40]2[CH2:41]1>>[O:5]=[C:6]1[CH:7]([CH:8]([CH2:9][CH2:10][CH2:11][CH:12]([CH2:13][N:14]2[C:15](=[O:24])[c:16]3[c:17]([cH:20][cH:21][cH:22][cH:23]3)[C:18]2=[O:19])[CH3:25])[CH3:26])[C:27]2([CH3:44])[CH2:28][CH2:29][CH:30]3[C:31]4([CH3:43])[CH2:32][CH2:33][CH:34]([OH:42])[CH2:35][C:36]4=[CH:37][CH2:38][CH:39]3[CH:40]2[CH2:41]1Participants
7
Sources & evidence
- ORD record
- ord-7b83424458a14d24b380c08d66bcab0f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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