Methylparaben → HCID 23512412, compound
Reaction equation
[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH:23]([CH2:38][OH:39])[CH2:24][CH:25]([O:27][c:28]2[cH:29][c:30]3[cH:31][cH:32][cH:33][cH:34][c:35]3[cH:36][cH:37]2)[CH2:26]1.[CH2:70]1[O:71][CH2:72][CH2:73][CH2:74]1.[O:1]=[C:2]([O:3][CH:4]([CH3:5])[CH3:6])[N:7]=[N:8][C:9]([O:10][CH:11]([CH3:12])[CH3:13])=[O:14].[OH:40][c:41]1[cH:42][cH:43][c:44]([C:45](=[O:46])[O:47][CH3:48])[cH:49][cH:50]1.[c:51]1([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66][cH:67][cH:68][cH:69]1>>[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH:23]([CH2:38][O:39][c:41]2[cH:42][cH:43][c:44]([C:45](=[O:46])[O:47][CH3:48])[cH:49][cH:50]2)[CH2:24][CH:25]([O:27][c:28]2[cH:29][c:30]3[cH:31][cH:32][cH:33][cH:34][c:35]3[cH:36][cH:37]2)[CH2:26]1Participants
6
Sources & evidence
- ORD record
- ord-fd71d5d4682940c2862c5a49e0ae10cd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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