Acetate → HCID 178485356, compound
Reaction equation
[C:46]([O:47][BH-:48]([O:49][C:50](=[O:51])[CH3:52])[O:53][C:54](=[O:55])[CH3:56])(=[O:57])[CH3:58].[CH3:42][C:43](=[O:44])[O-:45].[CH3:60][C:61](=[O:62])[OH:63].[CH3:65][CH2:66][N:67]([CH2:68][CH3:69])[CH2:70][CH3:71].[CH:27](=[O:28])[CH:29]1[CH2:30][CH2:31][N:32]([C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[CH2:33][CH2:34]1.[Cl:2][c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[N:9]([CH3:10])[CH:11]2[CH:12]([c:17]3[cH:18][c:19]([Cl:24])[c:20]([Cl:23])[cH:21][cH:22]3)[CH2:13][NH:14][CH2:15][CH2:16]2)[cH:25][cH:26]1.[ClH:1].[Na+:59].[OH2:64]>>[Cl:2][c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[N:9]([CH3:10])[CH:11]2[CH:12]([c:17]3[cH:18][c:19]([Cl:24])[c:20]([Cl:23])[cH:21][cH:22]3)[CH2:13][N:14]([CH2:27][CH:29]3[CH2:30][CH2:31][N:32]([C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[CH2:33][CH2:34]3)[CH2:15][CH2:16]2)[cH:25][cH:26]1Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-36acdd072da74494b5e6ae4366026dc8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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