Water → HCID 76124346, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([NH:8][C:9]([c:10]1[cH:11][cH:12][c:13]([NH2:16])[cH:14][cH:15]1)=[O:17])[CH2:18][C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26].[C:27]([CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42])(=[O:43])[O:44][CH:45]([CH2:46][S:47][CH2:48][CH2:49][C:50](=[O:51])[OH:52])[CH2:53][O:54][C:55]([CH2:56][CH2:57][CH2:58][CH2:59][CH2:60][CH2:61][CH2:62][CH2:63][CH2:64][CH2:65][CH2:66][CH2:67][CH2:68][CH2:69][CH3:70])=[O:71].[Cl:79][P:80]([Cl:81])[Cl:82].[OH2:72].[cH:73]1[cH:74][cH:75][n:76][cH:77][cH:78]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([NH:8][C:9]([c:10]1[cH:11][cH:12][c:13]([NH:16][C:50]([CH2:49][CH2:48][S:47][CH2:46][CH:45]([O:44][C:27]([CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42])=[O:43])[CH2:53][O:54][C:55]([CH2:56][CH2:57][CH2:58][CH2:59][CH2:60][CH2:61][CH2:62][CH2:63][CH2:64][CH2:65][CH2:66][CH2:67][CH2:68][CH2:69][CH3:70])=[O:71])=[O:51])[cH:14][cH:15]1)=[O:17])[CH2:18][C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26]Participants
6
Sources & evidence
- ORD record
- ord-a8bb18211c884499b9dfac331aa5c886
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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