Water → HCID 10136942, compound
Reaction equation
[C:64]([Cl:65])([Cl:66])([Cl:67])[Cl:68].[CH3:53][CH2:54][N:55]([CH2:56][CH3:57])[CH2:58][CH3:59].[CH3:60][C:61]#[N:62].[CH:8]1([CH2:13][CH:14]([C:15](=[O:16])[OH:17])[c:18]2[cH:19][cH:20][c:21](-[c:24]3[cH:25][cH:26][cH:27][c:28]4[cH:29][cH:30][cH:31][cH:32][c:33]34)[cH:22][cH:23]2)[CH2:9][CH2:10][CH2:11][CH2:12]1.[NH2:1][c:2]1[n:3][cH:4][cH:5][cH:6][cH:7]1.[OH2:63].[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>>[NH:1]([c:2]1[n:3][cH:4][cH:5][cH:6][cH:7]1)[C:15]([CH:14]([CH2:13][CH:8]1[CH2:9][CH2:10][CH2:11][CH2:12]1)[c:18]1[cH:19][cH:20][c:21](-[c:24]2[cH:25][cH:26][cH:27][c:28]3[cH:29][cH:30][cH:31][cH:32][c:33]23)[cH:22][cH:23]1)=[O:16]Participants
8
Sources & evidence
- ORD record
- ord-d3a52c32b05640758c992517af9041df
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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