Water → HCID 23593725, compound
Reaction equation
[CH2:54]1[O:55][CH2:56][CH2:57][CH2:58]1.[N:1](=[N+:2]=[N-:3])[CH:4]1[CH:5]([NH:13][c:14]2[n:15][c:16]([CH:31]3[CH2:32][CH2:33]3)[c:17](-[c:23]3[c:24]([Cl:30])[cH:25][c:26]([Cl:29])[cH:27][cH:28]3)[n:18][c:19]2[CH:20]2[CH2:21][CH2:22]2)[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[CH2:12]1.[OH2:53].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[NH2:1][CH:4]1[CH:5]([NH:13][c:14]2[n:15][c:16]([CH:31]3[CH2:32][CH2:33]3)[c:17](-[c:23]3[c:24]([Cl:30])[cH:25][c:26]([Cl:29])[cH:27][cH:28]3)[n:18][c:19]2[CH:20]2[CH2:21][CH2:22]2)[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[CH2:12]1Participants
5
Sources & evidence
- ORD record
- ord-0e69c0fada9f44d69c09cbcd5b94fd1d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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