Phenol → HCID 178480042, compound
Reaction equation
[CH2:73]1[O:74][CH2:75][CH2:76][CH2:77]1.[O:59]=[C:60]([O:61][CH:62]([CH3:63])[CH3:64])[N:65]=[N:66][C:67]([O:68][CH:69]([CH3:70])[CH3:71])=[O:72].[OH:1][CH2:2][CH2:3][CH:4]([C:5](=[O:6])[N:7]1[CH2:8][C:9]2([CH:10]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:11][N:12]([CH3:15])[C:13]2=[O:14])[CH2:22][CH2:23][CH2:24]1)[NH:25][C:26]([O:27][C:28]([CH3:29])([CH3:30])[CH3:31])=[O:32].[OH:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[c:40]1([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[cH:54][cH:55][cH:56][cH:57][cH:58]1>>[O:1]([CH2:2][CH2:3][CH:4]([C:5](=[O:6])[N:7]1[CH2:8][C:9]2([CH:10]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:11][N:12]([CH3:15])[C:13]2=[O:14])[CH2:22][CH2:23][CH2:24]1)[NH:25][C:26]([O:27][C:28]([CH3:29])([CH3:30])[CH3:31])=[O:32])[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1Participants
6
Sources & evidence
- ORD record
- ord-626f0952e9c1401390c089d7f70c3e77
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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