Water → HCID 178472192, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]([CH3:7])[O:8][CH:9]1[CH:10]([NH:32][C:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)=[O:40])[C:11](=[O:31])[N:12]1[CH:13]([Cl:14])[C:15](=[O:16])[O:17][CH:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[CH:68]([Cl:69])([Cl:70])[Cl:71].[OH2:67].[c:48]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]([CH3:7])[O:8][CH:9]1[CH:10]([NH:32][C:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)=[O:40])[C:11](=[O:31])[N:12]1[C:13]([C:15](=[O:16])[O:17][CH:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)=[P:54]([c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)([c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1)[c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1Participants
6
Sources & evidence
- ORD record
- ord-ebc5b28e2e92490cb8a25e2fa9eae614
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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