Water → HCID 178520501, compound
Reaction equation
[Cl:47][CH2:48][Cl:49].[O:28]1[CH:29]([O:34][NH2:35])[CH2:30][CH2:31][CH2:32][CH2:33]1.[OH2:46].[OH:36][n:37]1[c:38]2[c:39]([cH:40][cH:41][cH:42][cH:43]2)[n:44][n:45]1.[c:1]1([CH2:7][CH2:8][CH2:9][N:10]2[CH2:11][CH:12]([NH:16][c:17]3[n:18][cH:19][c:20]([CH:23]=[CH:24][C:25](=[O:26])[OH:27])[n:21][cH:22]3)[CH2:13][CH2:14][CH2:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][CH2:9][N:10]2[CH2:11][CH:12]([NH:16][c:17]3[n:18][cH:19][c:20]([CH:23]=[CH:24][C:25](=[O:27])[NH:35][O:34][CH:29]4[O:28][CH2:33][CH2:32][CH2:31][CH2:30]4)[n:21][cH:22]3)[CH2:13][CH2:14][CH2:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
6
Sources & evidence
- ORD record
- ord-0684e3a3860945ccb17885033aa93084
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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