Acetic Acid → HCID 67998999, compound
Reaction equation
[C:41]([O:42][BH-:43]([O:44][C:45](=[O:46])[CH3:47])[O:48][C:49](=[O:50])[CH3:51])(=[O:52])[CH3:53].[CH3:55][C:56](=[O:57])[OH:58].[CH:32]12[CH2:33][NH:34][CH2:35][CH:36]([CH2:37][CH2:38]1)[O:39]2.[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][C:10]([CH3:27])([CH2:28][C:29](=[O:30])[OH:31])[C:11](=[O:26])[N:12]([CH:21]([CH:22]=[O:23])[CH2:24][CH3:25])[CH:13]2[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:5][cH:6][cH:7]1.[ClH:40].[Na+:54]>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][C:10]([CH3:27])([CH2:28][C:29](=[O:30])[OH:31])[C:11](=[O:26])[N:12]([CH:21]([CH2:22][N:34]3[CH2:33][CH:32]4[CH2:38][CH2:37][CH:36]([CH2:35]3)[O:39]4)[CH2:24][CH3:25])[CH:13]2[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:5][cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-1d70b778867b412d841c9abb3bc2ee02
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…