Ethyl Acetate → HCID 135885195, compound
Reaction equation
[CH3:1][C:2]([CH2:3][CH2:4][C:5]1([NH:34][CH2:35][c:36]2[c:37]([N+:42]([O-:43])=[O:44])[cH:38][cH:39][cH:40][cH:41]2)[C:6](=[O:33])[C:7]([C:16]2=[N:17][S:18](=[O:31])(=[O:32])[c:19]3[c:20]([cH:22][cH:23][c:24]([NH:26][S:27](=[O:28])(=[O:29])[CH3:30])[cH:25]3)[NH:21]2)=[C:8]([OH:15])[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]21)([CH3:45])[CH3:46].[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52]>>[CH3:1][C:2]([CH2:3][CH2:4][C:5]1([NH:34][CH2:35][c:36]2[c:37]([NH2:42])[cH:38][cH:39][cH:40][cH:41]2)[C:6](=[O:33])[C:7]([C:16]2=[N:17][S:18](=[O:31])(=[O:32])[c:19]3[c:20]([cH:22][cH:23][c:24]([NH:26][S:27](=[O:28])(=[O:29])[CH3:30])[cH:25]3)[NH:21]2)=[C:8]([OH:15])[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]21)([CH3:45])[CH3:46]Participants
3
Sources & evidence
- ORD record
- ord-b3cd7bba99484facb044a514232e2c93
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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