Phenylacetic Acid → HCID 67333180, compound
Reaction equation
[C:22]([CH3:23])([CH3:24])([CH3:25])[O:26][C:27]([CH:28]([CH2:29][CH2:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[NH:38][C:39](=[O:40])[c:41]1[cH:42][cH:43][c:44](-[c:47]2[cH:48][cH:49][c:50]([NH2:53])[cH:51][cH:52]2)[cH:45][cH:46]1)=[O:54].[CH3:11][CH2:12][N:13]=[C:14]=[N:15][CH2:16][CH2:17][CH2:18][N:19]([CH3:20])[CH3:21].[CH3:55][CH2:56][N:57]([CH2:58][CH3:59])[CH2:60][CH3:61].[CH3:67][N:68]([c:69]1[cH:70][cH:71][n:72][cH:73][cH:74]1)[CH3:75].[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH:1][C:2](=[O:3])[CH2:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[C:2](=[O:3])([CH2:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[NH:53][c:50]1[cH:49][cH:48][c:47](-[c:44]2[cH:43][cH:42][c:41]([C:39]([NH:38][CH:28]([C:27]([O:26][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:54])[CH2:29][CH2:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])=[O:40])[cH:46][cH:45]2)[cH:52][cH:51]1Participants
7
Sources & evidence
- ORD record
- ord-1655d1a18c0c4167ab2181b3034a06b1
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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