Acetate → HCID 54494140, compound
Reaction equation
[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([NH2:11])[c:7]([Cl:10])[cH:8][cH:9]1)=[O:12].[CH3:22][C:23](=[O:24])[O-:25].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[ClH:31].[N:13]([O-:14])=[O:15].[NH2:17][C:18](=[O:19])[NH2:20].[Na+:16].[Na+:21].[OH2:32].[SH:26][CH2:27][C:28](=[O:29])[OH:30]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([S:26][CH2:27][C:28](=[O:29])[OH:30])[c:7]([Cl:10])[cH:8][cH:9]1)=[O:12]Participants
10
Sources & evidence
- ORD record
- ord-2d36bcd859a744468b36e0b9a24d0af5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…