Vanillin → HCID 178492559, compound
Reaction equation
[C:12]([CH3:13])([CH3:14])([CH3:15])[O:16][C:17](=[O:18])[N:19]1[CH2:20][CH:21]([OH:24])[CH2:22][CH2:23]1.[O:1]=[CH:2][c:3]1[cH:4][c:5]([O:6][CH3:7])[c:8]([OH:9])[cH:10][cH:11]1.[O:44]=[C:45]([O:46][CH2:47][CH3:48])[N:49]=[N:50][C:51]([O:52][CH2:53][CH3:54])=[O:55].[O:56]1[CH2:57][CH2:58][CH2:59][CH2:60]1.[c:25]1([P:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[O:1]=[CH:2][c:3]1[cH:4][c:5]([O:6][CH3:7])[c:8]([O:9][CH:21]2[CH2:20][N:19]([C:17]([O:16][C:12]([CH3:13])([CH3:14])[CH3:15])=[O:18])[CH2:23][CH2:22]2)[cH:10][cH:11]1Participants
6
Sources & evidence
- ORD record
- ord-3e152046fbe644a18fa52f7710d0e224
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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