Water → HCID 18462057, compound
Reaction equation
[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl:1][c:2]1[cH:3][c:4]([CH:9]([CH2:10][C:11](=[O:12])[OH:13])[C:14](=[O:15])[O:16][CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:5][cH:6][c:7]1[Cl:8].[NH2:24][c:25]1[c:26]2[c:27]([n:28][c:29]3[c:34]1[CH2:33][NH:32][CH2:31][CH2:30]3)[CH2:35][CH2:36][CH2:37][CH2:38]2.[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH2:57]>>[Cl:1][c:2]1[cH:3][c:4]([CH:9]([CH2:10][C:11](=[O:13])[N:32]2[CH2:31][CH2:30][c:29]3[n:28][c:27]4[c:26]([c:25]([NH2:24])[c:34]3[CH2:33]2)[CH2:38][CH2:37][CH2:36][CH2:35]4)[C:14](=[O:15])[O:16][CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:5][cH:6][c:7]1[Cl:8]Participants
7
Sources & evidence
- ORD record
- ord-bde2c767bbb446a5b2bf5f3c388ad791
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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